2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-pyridine

Systemtic Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-pyridine Openeye Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-pyridine CAS Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-5-nitropyridine IUPAC Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine Traditional Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-5-nitro-pyridine Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NC(=NN2)SC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)C2=NC(=NN2)SC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O2S/c18-17(19)9-5-6-10(13-7-9)20-12-14-11(15-16-12)8-3-1-2-4-8/h5-8H,1-4H2,(H,14,15,16)