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

Systemtic Name: 4-(4-butan-2-ylphenyl)sulfonyl-N-(4-butylphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-butylphenyl)-4-(4-sec-butylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: 4-(4-butan-2-ylphenyl)sulfonyl-N-(4-butylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-butan-2-ylphenyl)sulfonyl-N-(4-butylphenyl)piperazine-1-carbothioamide Traditional Name: N-(4-butylphenyl)-4-(4-sec-butylphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C25H35N3O2S2 MolecularWeight: 473.6943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)CC

InChI

InChI=1S/C25H35N3O2S2/c1-4-6-7-21-8-12-23(13-9-21)26-25(31)27-16-18-28(19-17-27)32(29,30)24-14-10-22(11-15-24)20(3)5-2/h8-15,20H,4-7,16-19H2,1-3H3,(H,26,31)