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

Systemtic Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-pyridine Openeye Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-pyridine CAS Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-3-nitropyridine IUPAC Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitropyridine Traditional Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-pyridine Formula: C14H17N5O2S MolecularWeight: 319.38208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O2S/c1-10-16-17-14(18(10)11-6-3-2-4-7-11)22-13-12(19(20)21)8-5-9-15-13/h5,8-9,11H,2-4,6-7H2,1H3