N-[[4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[[4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-3-oxo-cyclohexa-1,5-dien-1-yl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[[4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]amino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[3-keto-4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]thiocarbamoyl]-2-phenyl-acetamide Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C3C=CC(=CC3=O)NC(=S)NC(=O)CC4=CC=CC=C4)O2

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C3C=CC(=CC3=O)NC(=S)NC(=O)CC4=CC=CC=C4)O2

InChI

InChI=1S/C23H19N3O3S/c1-14-7-10-18-20(11-14)29-22(25-18)17-9-8-16(13-19(17)27)24-23(30)26-21(28)12-15-5-3-2-4-6-15/h2-11,13,25H,12H2,1H3,(H2,24,26,28,30)