N-(phenylcarbamothioyl)-3-[4-(phenylmethyl)piperazin-1-yl]propanamide

Systemtic Name: N-(phenylcarbamothioyl)-3-[4-(phenylmethyl)piperazin-1-yl]propanamide Openeye Name: 3-(4-benzylpiperazin-1-yl)-N-(phenylcarbamothioyl)propanamide CAS Name: N-[anilino(sulfanylidene)methyl]-3-[4-(phenylmethyl)-1-piperazinyl]propanamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)-N-(phenylcarbamothioyl)propanamide Traditional Name: 3-(4-benzylpiperazino)-N-(phenylthiocarbamoyl)propionamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC(=S)NC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCC(=O)NC(=S)NC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4OS/c26-20(23-21(27)22-19-9-5-2-6-10-19)11-12-24-13-15-25(16-14-24)17-18-7-3-1-4-8-18/h1-10H,11-17H2,(H2,22,23,26,27)