methyl 1-[2-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[2-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[2-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-oxo-ethyl]-5-nitro-2-oxo-pyridine-3-carboxylate CAS Name: 1-[2-[2,5-dimethyl-1-(2-thiazolyl)-3-pyrrolyl]-2-oxoethyl]-5-nitro-2-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxoethyl]-5-nitro-2-oxopyridine-3-carboxylate Traditional Name: 1-[2-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-keto-ethyl]-2-keto-5-nitro-nicotinic acid methyl ester Formula: C18H16N4O6S MolecularWeight: 416.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NC=CS2)C)C(=O)CN3C=C(C=C(C3=O)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=NC=CS2)C)C(=O)CN3C=C(C=C(C3=O)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O6S/c1-10-6-13(11(2)21(10)18-19-4-5-29-18)15(23)9-20-8-12(22(26)27)7-14(16(20)24)17(25)28-3/h4-8H,9H2,1-3H3