N-(4-butan-2-ylphenyl)-4-(4-propan-2-ylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-(4-propan-2-ylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: 4-(4-isopropylphenyl)sulfonyl-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-(4-propan-2-ylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: 4-p-cumenylsulfonyl-N-(4-sec-butylphenyl)piperazine-1-carbothioamide Formula: C24H33N3O2S2 MolecularWeight: 459.66772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H33N3O2S2/c1-5-19(4)21-6-10-22(11-7-21)25-24(30)26-14-16-27(17-15-26)31(28,29)23-12-8-20(9-13-23)18(2)3/h6-13,18-19H,5,14-17H2,1-4H3,(H,25,30)