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

Systemtic Name: 2-nitro-N-[4-(4-propan-2-yloxyphenyl)-1,3-thiazol-2-yl]benzenesulfonamide Openeye Name: N-[4-(4-isopropoxyphenyl)thiazol-2-yl]-2-nitro-benzenesulfonamide CAS Name: 2-nitro-N-[4-(4-propan-2-yloxyphenyl)-2-thiazolyl]benzenesulfonamide IUPAC Name: 2-nitro-N-[4-(4-propan-2-yloxyphenyl)-1,3-thiazol-2-yl]benzenesulfonamide Traditional Name: N-[4-(4-isopropoxyphenyl)thiazol-2-yl]-2-nitro-benzenesulfonamide Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2=CSC(=N2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2=CSC(=N2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O5S2/c1-12(2)26-14-9-7-13(8-10-14)15-11-27-18(19-15)20-28(24,25)17-6-4-3-5-16(17)21(22)23/h3-12H,1-2H3,(H,19,20)