1-[[5-(3-nitropyridin-2-yl)sulfanyl-4-pyridin-2-yl-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[5-(3-nitropyridin-2-yl)sulfanyl-4-pyridin-2-yl-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-one Openeye Name: 1-[[5-[(3-nitro-2-pyridyl)sulfanyl]-4-(2-pyridyl)-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-one CAS Name: 1-[[5-[(3-nitro-2-pyridinyl)thio]-4-(2-pyridinyl)-1,2,4-triazol-3-yl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[5-(3-nitropyridin-2-yl)sulfanyl-4-pyridin-2-yl-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-one Traditional Name: 1-[[5-[(3-nitro-2-pyridyl)thio]-4-(2-pyridyl)-1,2,4-triazol-3-yl]methyl]-2-pyrrolidone Formula: C17H15N7O3S MolecularWeight: 397.4111

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=NN=C(N2C3=CC=CC=N3)SC4=C(C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)CC2=NN=C(N2C3=CC=CC=N3)SC4=C(C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C17H15N7O3S/c25-15-7-4-10-22(15)11-14-20-21-17(23(14)13-6-1-2-8-18-13)28-16-12(24(26)27)5-3-9-19-16/h1-3,5-6,8-9H,4,7,10-11H2