2-(4-chlorophenyl)sulfanyl-N-[[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(p-tolyl)-1,3-benzoxazol-5-yl]carbamothioyl]acetamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[[[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]acetamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[[2-(p-tolyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]acetamide Formula: C23H18ClN3O2S2 MolecularWeight: 467.99092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClN3O2S2/c1-14-2-4-15(5-3-14)22-26-19-12-17(8-11-20(19)29-22)25-23(30)27-21(28)13-31-18-9-6-16(24)7-10-18/h2-12H,13H2,1H3,(H2,25,27,28,30)