(5-methyl-1,2-benzothiazol-3-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (5-methyl-1,2-benzothiazol-3-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (5-methyl-1,2-benzothiazol-3-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (5-methyl-1,2-benzothiazol-3-yl)-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (5-methyl-1,2-benzothiazol-3-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-mesitylsulfonylpiperazino)-(5-methyl-1,2-benzothiazol-3-yl)methanone Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SN=C2C(=O)N3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)SN=C2C(=O)N3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4C)C)C

InChI

InChI=1S/C22H25N3O3S2/c1-14-5-6-19-18(13-14)20(23-29-19)22(26)24-7-9-25(10-8-24)30(27,28)21-16(3)11-15(2)12-17(21)4/h5-6,11-13H,7-10H2,1-4H3