4-(diphenylmethyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-(diphenylmethyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide Openeye Name: 4-benzhydryl-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide CAS Name: 4-(diphenylmethyl)-N-[3-(methylthio)propyl]-1-piperazinecarbothioamide IUPAC Name: 4-benzhydryl-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide Traditional Name: 4-benzhydryl-N-[3-(methylthio)propyl]piperazine-1-carbothioamide Formula: C22H29N3S2 MolecularWeight: 399.61576

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CSCCCNC(=S)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3S2/c1-27-18-8-13-23-22(26)25-16-14-24(15-17-25)21(19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-7,9-12,21H,8,13-18H2,1H3,(H,23,26)