4-(2,5-dimethylphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2,5-dimethylphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2,5-dimethylphenyl)sulfonyl-N-(4-isopropylphenyl)piperazine-1-carbothioamide CAS Name: 4-(2,5-dimethylphenyl)sulfonyl-N-(4-propan-2-ylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,5-dimethylphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,5-dimethylphenyl)sulfonyl-N-p-cumenyl-piperazine-1-carbothioamide Formula: C22H29N3O2S2 MolecularWeight: 431.61456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H29N3O2S2/c1-16(2)19-7-9-20(10-8-19)23-22(28)24-11-13-25(14-12-24)29(26,27)21-15-17(3)5-6-18(21)4/h5-10,15-16H,11-14H2,1-4H3,(H,23,28)