N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-nitro-benzenesulfonamide Formula: C17H15N3O6S2 MolecularWeight: 421.4475

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C17H15N3O6S2/c1-25-15-7-6-11(8-16(15)26-2)14-10-27-17(18-14)19-28(23,24)13-5-3-4-12(9-13)20(21)22/h3-10H,1-2H3,(H,18,19)