(Z)-3-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-phenyl]-2-pyridin-2-yl-prop-2-enenitrile

Systemtic Name: (Z)-3-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-phenyl]-2-pyridin-2-yl-prop-2-enenitrile Openeye Name: (Z)-3-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-phenyl]-2-(2-pyridyl)prop-2-enenitrile CAS Name: (Z)-3-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitrophenyl]-2-(2-pyridinyl)-2-propenenitrile IUPAC Name: (Z)-3-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrophenyl]-2-pyridin-2-ylprop-2-enenitrile Traditional Name: (Z)-3-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-phenyl]-2-(2-pyridyl)acrylonitrile Formula: C17H12N6O2S MolecularWeight: 364.38118

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=C(C=C(C=C2)C=C(C#N)C3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NN=C1SC2=C(C=C(C=C2)/C=C(\C#N)/C3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N6O2S/c1-22-11-20-21-17(22)26-16-6-5-12(9-15(16)23(24)25)8-13(10-18)14-4-2-3-7-19-14/h2-9,11H,1H3/b13-8+