N-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]carbothioylbenzamide

Systemtic Name: N-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]carbothioylbenzamide Openeye Name: N-[4-(4-chlorobenzoyl)piperazine-1-carbothioyl]benzamide CAS Name: N-[[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: N-[4-(4-chlorobenzoyl)piperazine-1-carbothioyl]benzamide Traditional Name: N-[4-(4-chlorobenzoyl)piperazine-1-carbothioyl]benzamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H18ClN3O2S/c20-16-8-6-15(7-9-16)18(25)22-10-12-23(13-11-22)19(26)21-17(24)14-4-2-1-3-5-14/h1-9H,10-13H2,(H,21,24,26)