3-[(2S)-1-(4-methyl-3-nitro-phenyl)sulfonylpyrrolidin-2-yl]-[1,2,4]triazolo[4,3-a]pyridine

Systemtic Name: 3-[(2S)-1-(4-methyl-3-nitro-phenyl)sulfonylpyrrolidin-2-yl]-[1,2,4]triazolo[4,3-a]pyridine Openeye Name: 3-[(2S)-1-(4-methyl-3-nitro-phenyl)sulfonylpyrrolidin-2-yl]-[1,2,4]triazolo[4,3-a]pyridine CAS Name: 3-[(2S)-1-(4-methyl-3-nitrophenyl)sulfonyl-2-pyrrolidinyl]-[1,2,4]triazolo[4,3-a]pyridine IUPAC Name: 3-[(2S)-1-(4-methyl-3-nitrophenyl)sulfonylpyrrolidin-2-yl]-[1,2,4]triazolo[4,3-a]pyridine Traditional Name: 3-[(2S)-1-(4-methyl-3-nitro-phenyl)sulfonylpyrrolidin-2-yl]-[1,2,4]triazolo[4,3-a]pyridine Formula: C17H17N5O4S MolecularWeight: 387.41298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2C3=NN=C4N3C=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC[C@H]2C3=NN=C4N3C=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4S/c1-12-7-8-13(11-15(12)22(23)24)27(25,26)21-10-4-5-14(21)17-19-18-16-6-2-3-9-20(16)17/h2-3,6-9,11,14H,4-5,10H2,1H3/t14-/m0/s1