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

Systemtic Name: 3-[5-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-[2-(2-methyl-5-nitro-1-imidazolyl)ethylthio]-4-phenyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-[2-(2-methyl-5-nitroimidazol-1-yl)ethylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylthio]-4-phenyl-1,2,4-triazol-3-yl]pyridine Formula: C19H17N7O2S MolecularWeight: 407.44898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCSC2=NN=C(N2C3=CC=CC=C3)C4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCSC2=NN=C(N2C3=CC=CC=C3)C4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N7O2S/c1-14-21-13-17(26(27)28)24(14)10-11-29-19-23-22-18(15-6-5-9-20-12-15)25(19)16-7-3-2-4-8-16/h2-9,12-13H,10-11H2,1H3