![3-({[(3-Methoxy-2-naphthoyl)amino]carbonothioyl}amino)-4-methylbenzoic acid structure](/static/products/4336/433697-67-7.webp)
3-({[(3-Methoxy-2-naphthoyl)amino]carbonothioyl}amino)-4-methylbenzoic acid
3-[(3-methoxynaphthalene-2-carbonyl)carbamothioylamino]-4-methylbenzoic acid
Also Known As: Oprea1_110911|3-({[(3-methoxy-2-naphthoyl)amino]carbonothioyl}amino)-4-methylbenzoic acid|3-(3-(3-methoxy-2-naphthoyl)thioureido)-4-methylbenzoic acid|3-[(3-methoxynaphthalene-2-carbonyl)carbamothioylamino]-4-methylbenzoic acid|3-[[[[carbonyl]amino]thioxomethyl]amino]-4-methyl-benzoicacid|3-({[(3-methoxynaphthalen-2-yl)carbonyl]carbamothioyl}amino)-4-methylbenzoic acid|3-[(3-methoxy-2-naphthoyl)thiocarbamoylamino]-4-methyl-benzoic acid|3-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOICACID|3-[(3-methoxynaphthalen-2-yl)carbonylcarbamothioylamino]-4-methyl-benzoic acid|3-[(3-methoxynaphthalene-2-carbonyl)thiocarbamoylamino]-4-methyl-benzoic Acid|3-[[[[(3-methoxy-2-naphthalenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methylbenzoic acid|3-[[[[(3-METHOXY-2-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID
| Molecular Formula | C21H18N2O4S |
|---|---|
| Molecular Weight | 394.09872 g/mol |
| LogP | 3.98182 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.09872 |
| Monoisotopic Mass | 394.09872 |
| Heavy Atoms | 28 |
| Complexity | 1094.9558 |
Chemical Identifiers
| CAS Number | 433697-67-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC3=CC=CC=C3C=C2OC |
Product Overview
3-({[(3-Methoxy-2-naphthoyl)amino]carbonothioyl}amino)-4-methylbenzoic acid (CAS 433697-67-7), with molecular formula C21H18N2O4S and molecular weight 394.09872 g/mol. IUPAC: 3-[(3-methoxynaphthalene-2-carbonyl)carbamothioylamino]-4-methylbenzoic acid.