4-methyl-3-nitro-N-[4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]carbonylphenyl]benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-[4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]carbonylphenyl]benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[4-(4-thiazol-2-ylpiperazine-1-carbonyl)phenyl]benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[4-[oxo-[4-(2-thiazolyl)-1-piperazinyl]methyl]phenyl]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-[4-[4-(1,3-thiazol-2-yl)piperazine-1-carbonyl]phenyl]benzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-[4-(4-thiazol-2-ylpiperazine-1-carbonyl)phenyl]benzenesulfonamide Formula: C21H21N5O5S2 MolecularWeight: 487.55194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=CS4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O5S2/c1-15-2-7-18(14-19(15)26(28)29)33(30,31)23-17-5-3-16(4-6-17)20(27)24-9-11-25(12-10-24)21-22-8-13-32-21/h2-8,13-14,23H,9-12H2,1H3