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

Systemtic Name: (Z)-3-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]-2-pyridin-2-yl-prop-2-enenitrile Openeye Name: (Z)-3-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]-2-(2-pyridyl)prop-2-enenitrile CAS Name: (Z)-3-[4-[(1-methyl-2-imidazolyl)thio]-3-nitrophenyl]-2-(2-pyridinyl)-2-propenenitrile IUPAC Name: (Z)-3-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitrophenyl]-2-pyridin-2-ylprop-2-enenitrile Traditional Name: (Z)-3-[4-[(1-methylimidazol-2-yl)thio]-3-nitro-phenyl]-2-(2-pyridyl)acrylonitrile Formula: C18H13N5O2S MolecularWeight: 363.39312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13N5O2S/c1-22-9-8-21-18(22)26-17-6-5-13(11-16(17)23(24)25)10-14(12-19)15-4-2-3-7-20-15/h2-11H,1H3/b14-10+