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

Systemtic Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-imidazo[1,2-a]pyridine Openeye Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-imidazo[1,2-a]pyridine CAS Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-3-nitroimidazo[1,2-a]pyridine IUPAC Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitroimidazo[1,2-a]pyridine Traditional Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-imidazo[1,2-a]pyridine Formula: C16H18N6O2S MolecularWeight: 358.41812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SC3=C(N4C=CC=CC4=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SC3=C(N4C=CC=CC4=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N6O2S/c1-11-18-19-16(21(11)12-7-3-2-4-8-12)25-14-15(22(23)24)20-10-6-5-9-13(20)17-14/h5-6,9-10,12H,2-4,7-8H2,1H3