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

Systemtic Name: (4-methyl-2-phenyl-1,3-thiazol-5-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-methyl-2-phenyl-thiazol-5-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (4-methyl-2-phenyl-5-thiazolyl)-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-methyl-2-phenyl-1,3-thiazol-5-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-methyl-2-phenyl-thiazol-5-yl)-[4-(2-nitrophenyl)sulfonylpiperazino]methanone Formula: C21H20N4O5S2 MolecularWeight: 472.5373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O5S2/c1-15-19(31-20(22-15)16-7-3-2-4-8-16)21(26)23-11-13-24(14-12-23)32(29,30)18-10-6-5-9-17(18)25(27)28/h2-10H,11-14H2,1H3