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

Systemtic Name: N-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2-(4-chlorophenyl)ethanamide Openeye Name: N-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2-(4-chlorophenyl)acetamide CAS Name: N-[[5-(1,3-benzoxazol-2-yl)-2-methylanilino]-sulfanylidenemethyl]-2-(4-chlorophenyl)acetamide IUPAC Name: N-[[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-2-(4-chlorophenyl)acetamide Traditional Name: N-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]thiocarbamoyl]-2-(4-chlorophenyl)acetamide Formula: C23H18ClN3O2S MolecularWeight: 435.92592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)NC(=S)NC(=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)NC(=S)NC(=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClN3O2S/c1-14-6-9-16(22-25-18-4-2-3-5-20(18)29-22)13-19(14)26-23(30)27-21(28)12-15-7-10-17(24)11-8-15/h2-11,13H,12H2,1H3,(H2,26,27,28,30)