N-[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]-2-phenylsulfanyl-acetamide CAS Name: N-[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]-2-(phenylthio)acetamide IUPAC Name: N-[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]-2-phenylsulfanylacetamide Traditional Name: N-[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]-2-(phenylthio)acetamide Formula: C21H16N2O3S MolecularWeight: 376.42834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)NC2=CC(=C3NC4=CC=CC=C4O3)C(=O)C=C2

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)NC2=C/C(=C\3/NC4=CC=CC=C4O3)/C(=O)C=C2

InChI

InChI=1S/C21H16N2O3S/c24-18-11-10-14(22-20(25)13-27-15-6-2-1-3-7-15)12-16(18)21-23-17-8-4-5-9-19(17)26-21/h1-12,23H,13H2,(H,22,25)/b21-16+