(2-phenyl-1,3-thiazol-4-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-phenylthiazol-4-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-phenyl-4-thiazolyl)-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-mesitylsulfonylpiperazino)-(2-phenylthiazol-4-yl)methanone Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CSC(=N3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CSC(=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H25N3O3S2/c1-16-13-17(2)21(18(3)14-16)31(28,29)26-11-9-25(10-12-26)23(27)20-15-30-22(24-20)19-7-5-4-6-8-19/h4-8,13-15H,9-12H2,1-3H3