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

Systemtic Name: N-(4-butan-2-ylphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2,3-dimethylphenyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-(2,3-dimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,3-dimethylphenyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide Formula: C23H31N3S MolecularWeight: 381.57734

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C23H31N3S/c1-5-17(2)20-9-11-21(12-10-20)24-23(27)26-15-13-25(14-16-26)22-8-6-7-18(3)19(22)4/h6-12,17H,5,13-16H2,1-4H3,(H,24,27)