N,N-dimethyl-3-[1-[(4-nitrophenyl)methyl]-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-3-yl]piperidine-1-sulfonamide

Systemtic Name: N,N-dimethyl-3-[1-[(4-nitrophenyl)methyl]-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-3-yl]piperidine-1-sulfonamide Openeye Name: N,N-dimethyl-3-[1-[(4-nitrophenyl)methyl]-5-oxo-4-(2-thienyl)-1,2,4-triazol-3-yl]piperidine-1-sulfonamide CAS Name: N,N-dimethyl-3-[1-[(4-nitrophenyl)methyl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-3-yl]-1-piperidinesulfonamide IUPAC Name: N,N-dimethyl-3-[1-[(4-nitrophenyl)methyl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-3-yl]piperidine-1-sulfonamide Traditional Name: 3-[5-keto-1-(4-nitrobenzyl)-4-(2-thienyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-piperidine-1-sulfonamide Formula: C20H24N6O5S2 MolecularWeight: 492.57176

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCCC(C1)C2=NN(C(=O)N2C3=CC=CS3)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)N1CCCC(C1)C2=NN(C(=O)N2C3=CC=CS3)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N6O5S2/c1-22(2)33(30,31)23-11-3-5-16(14-23)19-21-24(20(27)25(19)18-6-4-12-32-18)13-15-7-9-17(10-8-15)26(28)29/h4,6-10,12,16H,3,5,11,13-14H2,1-2H3