N-(4-butan-2-ylphenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: 4-(o-tolylmethyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-[(2-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(2-methylbenzyl)-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)CC3=CC=CC=C3C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C23H31N3S/c1-4-18(2)20-9-11-22(12-10-20)24-23(27)26-15-13-25(14-16-26)17-21-8-6-5-7-19(21)3/h5-12,18H,4,13-17H2,1-3H3,(H,24,27)