2-[(E)-2-(1-methyl-5-nitro-imidazol-2-yl)ethenyl]-5-pyridin-4-yl-1,3,4-thiadiazole

Systemtic Name: 2-[(E)-2-(1-methyl-5-nitro-imidazol-2-yl)ethenyl]-5-pyridin-4-yl-1,3,4-thiadiazole Openeye Name: 2-[(E)-2-(1-methyl-5-nitro-imidazol-2-yl)vinyl]-5-(4-pyridyl)-1,3,4-thiadiazole CAS Name: 2-[(E)-2-(1-methyl-5-nitro-2-imidazolyl)ethenyl]-5-pyridin-4-yl-1,3,4-thiadiazole IUPAC Name: 2-[(E)-2-(1-methyl-5-nitroimidazol-2-yl)ethenyl]-5-pyridin-4-yl-1,3,4-thiadiazole Traditional Name: 2-[(E)-2-(1-methyl-5-nitro-imidazol-2-yl)vinyl]-5-(4-pyridyl)-1,3,4-thiadiazole Formula: C13H10N6O2S MolecularWeight: 314.3225

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C=CC2=NN=C(S2)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1/C=C/C2=NN=C(S2)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H10N6O2S/c1-18-10(15-8-12(18)19(20)21)2-3-11-16-17-13(22-11)9-4-6-14-7-5-9/h2-8H,1H3/b3-2+