2-(4-chlorophenyl)-N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[[4-(4-pyridylmethyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[[4-(pyridin-4-ylmethyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[[4-(4-pyridylmethyl)phenyl]thiocarbamoyl]acetamide Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=NC=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=NC=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H18ClN3OS/c22-18-5-1-16(2-6-18)14-20(26)25-21(27)24-19-7-3-15(4-8-19)13-17-9-11-23-12-10-17/h1-12H,13-14H2,(H2,24,25,26,27)