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

Systemtic Name: 3-phenyl-N-[4-(phenylmethyl)piperazin-1-yl]carbothioyl-propanamide Openeye Name: N-(4-benzylpiperazine-1-carbothioyl)-3-phenyl-propanamide CAS Name: 3-phenyl-N-[[4-(phenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]propanamide IUPAC Name: N-(4-benzylpiperazine-1-carbothioyl)-3-phenylpropanamide Traditional Name: N-(4-benzylpiperazine-1-carbothioyl)-3-phenyl-propionamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=S)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=S)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3OS/c25-20(12-11-18-7-3-1-4-8-18)22-21(26)24-15-13-23(14-16-24)17-19-9-5-2-6-10-19/h1-10H,11-17H2,(H,22,25,26)