N-[2-[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-[4-methyl-2-(m-tolyl)thiazol-5-yl]ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[2-[4-methyl-2-(3-methylphenyl)-5-thiazolyl]ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-[4-methyl-2-(m-tolyl)thiazol-5-yl]ethyl]-3-nitro-benzenesulfonamide Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(S2)CCNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(S2)CCNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H19N3O4S2/c1-13-5-3-6-15(11-13)19-21-14(2)18(27-19)9-10-20-28(25,26)17-8-4-7-16(12-17)22(23)24/h3-8,11-12,20H,9-10H2,1-2H3