4-chloranyl-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitro-benzenesulfonamide hydrochloride

Systemtic Name: 4-chloranyl-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitro-benzenesulfonamide hydrochloride Openeye Name: 4-chloro-N-[4-(4-methoxyphenyl)thiazol-2-yl]-3-nitro-benzenesulfonamide hydrochloride CAS Name: 4-chloro-N-[4-(4-methoxyphenyl)-2-thiazolyl]-3-nitrobenzenesulfonamide hydrochloride IUPAC Name: 4-chloro-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitrobenzenesulfonamide hydrochloride Traditional Name: 4-chloro-N-[4-(4-methoxyphenyl)thiazol-2-yl]-3-nitro-benzenesulfonamide hydrochloride Formula: C16H13Cl2N3O5S2 MolecularWeight: 462.32752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12ClN3O5S2.ClH/c1-25-11-4-2-10(3-5-11)14-9-26-16(18-14)19-27(23,24)12-6-7-13(17)15(8-12)20(21)22;/h2-9H,1H3,(H,18,19);1H