4-(2,3-dimethylphenyl)-N-(2-methylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2,3-dimethylphenyl)-N-(2-methylpropyl)piperazine-1-carbothioamide Openeye Name: 4-(2,3-dimethylphenyl)-N-isobutyl-piperazine-1-carbothioamide CAS Name: 4-(2,3-dimethylphenyl)-N-(2-methylpropyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,3-dimethylphenyl)-N-(2-methylpropyl)piperazine-1-carbothioamide Traditional Name: 4-(2,3-dimethylphenyl)-N-isobutyl-piperazine-1-carbothioamide Formula: C17H27N3S MolecularWeight: 305.48138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=S)NCC(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=S)NCC(C)C)C

InChI

InChI=1S/C17H27N3S/c1-13(2)12-18-17(21)20-10-8-19(9-11-20)16-7-5-6-14(3)15(16)4/h5-7,13H,8-12H2,1-4H3,(H,18,21)