N-(4-tert-butylphenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-tert-butylphenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-tert-butylphenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-tert-butylphenyl)-4-[2-(methylthio)phenyl]-1-piperazinecarbothioamide IUPAC Name: N-(4-tert-butylphenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carbothioamide Traditional Name: N-(4-tert-butylphenyl)-4-[2-(methylthio)phenyl]piperazine-1-carbothioamide Formula: C22H29N3S2 MolecularWeight: 399.61576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC=C3SC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC=C3SC

InChI

InChI=1S/C22H29N3S2/c1-22(2,3)17-9-11-18(12-10-17)23-21(26)25-15-13-24(14-16-25)19-7-5-6-8-20(19)27-4/h5-12H,13-16H2,1-4H3,(H,23,26)