2-[(2-chlorophenyl)carbamothioylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[(2-chlorophenyl)carbamothioylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[(2-chlorophenyl)carbamothioylamino]benzamide CAS Name: 2-[[(2-chloroanilino)-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[(2-chlorophenyl)carbamothioylamino]benzamide Traditional Name: N-benzyl-2-[(2-chlorophenyl)thiocarbamoylamino]benzamide Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=S)NC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=S)NC3=CC=CC=C3Cl

InChI

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