AC1MRZVI
prop-2-enyl 6-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate
Also Known As: allyl 6-((2-((4-acetylphenyl)amino)-2-oxoethyl)thio)-5-cyano-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate|SR-01000484807-1|F1155-0468|PROP-2-EN-1-YL 6-({[(4-ACETYLPHENYL)CARBAMOYL]METHYL}SULFANYL)-5-CYANO-2-METHYL-4-(THIOPHEN-2-YL)-1,4-DIHYDROPYRIDINE-3-CARBOXYLATE|prop-2-enyl 6-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate|prop-2-en-1-yl 6-({2-[(4-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C25H23N3O4S2 |
|---|---|
| Molecular Weight | 493.113 g/mol |
| LogP | 4.74778 |
| Topological Polar Surface Area | 108.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 493.113 |
| Monoisotopic Mass | 493.113 |
| Heavy Atoms | 34 |
| Complexity | 1205.7855 |
Chemical Identifiers
| CAS Number | 370855-35-9 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)C(=O)C)C#N)C3=CC=CS3)C(=O)OCC=C |
Product Overview
AC1MRZVI (CAS 370855-35-9), with molecular formula C25H23N3O4S2 and molecular weight 493.113 g/mol. IUPAC: prop-2-enyl 6-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate.