N-[(2-chlorophenyl)methyl-(pyridin-3-ylmethyl)carbamothioyl]benzamide

Systemtic Name: N-[(2-chlorophenyl)methyl-(pyridin-3-ylmethyl)carbamothioyl]benzamide Openeye Name: N-[(2-chlorophenyl)methyl-(3-pyridylmethyl)carbamothioyl]benzamide CAS Name: N-[[(2-chlorophenyl)methyl-(3-pyridinylmethyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(2-chlorophenyl)methyl-(pyridin-3-ylmethyl)carbamothioyl]benzamide Traditional Name: N-[(2-chlorobenzyl)-(3-pyridylmethyl)thiocarbamoyl]benzamide Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=S)N(CC2=CN=CC=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=S)N(CC2=CN=CC=C2)CC3=CC=CC=C3Cl

InChI

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