(2-butyl-4-methyl-1,3-thiazol-5-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-butyl-4-methyl-1,3-thiazol-5-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-butyl-4-methyl-thiazol-5-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-butyl-4-methyl-5-thiazolyl)-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-butyl-4-methyl-1,3-thiazol-5-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-butyl-4-methyl-thiazol-5-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazino]methanone Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(S1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C)C

Isomeric SMILES

CCCCC1=NC(=C(S1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C)C

InChI

InChI=1S/C21H29N3O3S2/c1-5-6-7-19-22-17(4)20(28-19)21(25)23-10-12-24(13-11-23)29(26,27)18-9-8-15(2)16(3)14-18/h8-9,14H,5-7,10-13H2,1-4H3