3-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-[1,2,4]triazolo[4,3-a]pyridine

Systemtic Name: 3-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-[1,2,4]triazolo[4,3-a]pyridine Openeye Name: 3-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-[1,2,4]triazolo[4,3-a]pyridine CAS Name: 3-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]thio]-[1,2,4]triazolo[4,3-a]pyridine IUPAC Name: 3-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-[1,2,4]triazolo[4,3-a]pyridine Traditional Name: 3-[(2-nitro-4-pyrrolidinosulfonyl-phenyl)thio]-[1,2,4]triazolo[4,3-a]pyridine Formula: C16H15N5O4S2 MolecularWeight: 405.4514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NN=C4N3C=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NN=C4N3C=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O4S2/c22-21(23)13-11-12(27(24,25)19-8-3-4-9-19)6-7-14(13)26-16-18-17-15-5-1-2-10-20(15)16/h1-2,5-7,10-11H,3-4,8-9H2