N-[1-oxidanyl-3-(4-phenylpiperazin-1-yl)propan-2-yl]benzenecarbothioamide

Systemtic Name: N-[1-oxidanyl-3-(4-phenylpiperazin-1-yl)propan-2-yl]benzenecarbothioamide Openeye Name: N-[1-(hydroxymethyl)-2-(4-phenylpiperazin-1-yl)ethyl]benzenecarbothioamide CAS Name: N-[1-hydroxy-3-(4-phenyl-1-piperazinyl)propan-2-yl]benzenecarbothioamide IUPAC Name: N-[1-hydroxy-3-(4-phenylpiperazin-1-yl)propan-2-yl]benzenecarbothioamide Traditional Name: N-[1-methylol-2-(4-phenylpiperazino)ethyl]thiobenzamide Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CO)NC(=S)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC(CO)NC(=S)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3OS/c24-16-18(21-20(25)17-7-3-1-4-8-17)15-22-11-13-23(14-12-22)19-9-5-2-6-10-19/h1-10,18,24H,11-16H2,(H,21,25)