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

Systemtic Name: N-[[(4E)-4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[[(4E)-4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-3-oxo-cyclohexa-1,5-dien-1-yl]carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[[(4E)-4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]amino]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[[(4E)-4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[[(4E)-3-keto-4-(6-methyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]thiocarbamoyl]-2-phenoxy-acetamide Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C3C=CC(=CC3=O)NC(=S)NC(=O)COC4=CC=CC=C4)O2

Isomeric SMILES

CC1=CC2=C(C=C1)N/C(=C\3/C=CC(=CC3=O)NC(=S)NC(=O)COC4=CC=CC=C4)/O2

InChI

InChI=1S/C23H19N3O4S/c1-14-7-10-18-20(11-14)30-22(25-18)17-9-8-15(12-19(17)27)24-23(31)26-21(28)13-29-16-5-3-2-4-6-16/h2-12,25H,13H2,1H3,(H2,24,26,28,31)/b22-17+