N-cyclopropyl-4-(2,4-dimethylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-cyclopropyl-4-(2,4-dimethylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-cyclopropyl-4-(2,4-dimethylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-cyclopropyl-4-(2,4-dimethylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-cyclopropyl-4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-cyclopropyl-4-(2,4-dimethylphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C16H23N3O2S2 MolecularWeight: 353.50272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3CC3)C

InChI

InChI=1S/C16H23N3O2S2/c1-12-3-6-15(13(2)11-12)23(20,21)19-9-7-18(8-10-19)16(22)17-14-4-5-14/h3,6,11,14H,4-5,7-10H2,1-2H3,(H,17,22)