AC1NUF7W
(E)-N-[[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide
Also Known As: (2E)-N-{[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-3-(furan-2-yl)prop-2-enamide|(E)-N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-(furan-2-yl)acrylamide|(2E)-N-{[(3-benzoxazol-2-yl-4-hydroxyphenyl)amino]thioxomethyl}-3-(2-furyl)pro p-2-enamide|(E)-N-[[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide|(E)-N-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide
| Molecular Formula | C21H15N3O4S |
|---|---|
| Molecular Weight | 405.07834 g/mol |
| LogP | 4.3198 |
| Topological Polar Surface Area | 100.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.07834 |
| Monoisotopic Mass | 405.07834 |
| Heavy Atoms | 29 |
| Complexity | 1178.8871 |
Chemical Identifiers
| CAS Number | 401615-34-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=S)NC(=O)/C=C/C4=CC=CO4)O |
Product Overview
AC1NUF7W (CAS 401615-34-7), with molecular formula C21H15N3O4S and molecular weight 405.07834 g/mol. IUPAC: (E)-N-[[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide.
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