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

Systemtic Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-pyridine Openeye Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-pyridine CAS Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-5-nitropyridine IUPAC Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine Traditional Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-5-nitro-pyridine Formula: C14H11N5O2S MolecularWeight: 313.33444

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2=NC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1SC2=NC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C14H11N5O2S/c1-18-13(10-5-3-2-4-6-10)16-17-14(18)22-12-8-7-11(9-15-12)19(20)21/h2-9H,1H3