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

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(5-methyl-1,2-benzothiazol-3-yl)methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(5-methyl-1,2-benzothiazol-3-yl)methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(5-methyl-1,2-benzothiazol-3-yl)methanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(5-methyl-1,2-benzothiazol-3-yl)methanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-(5-methyl-1,2-benzothiazol-3-yl)methanone Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SN=C2C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)SN=C2C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C21H23N3O3S2/c1-14-4-7-19-18(12-14)20(22-28-19)21(25)23-8-10-24(11-9-23)29(26,27)17-6-5-15(2)16(3)13-17/h4-7,12-13H,8-11H2,1-3H3