N-(2-methylphenyl)-2-[4-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-(2-methylphenyl)-2-[4-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-[4-[(5-nitro-2-oxo-1-pyridyl)methyl]thiazol-2-yl]-N-(o-tolyl)acetamide CAS Name: N-(2-methylphenyl)-2-[4-[(5-nitro-2-oxo-1-pyridinyl)methyl]-2-thiazolyl]acetamide IUPAC Name: N-(2-methylphenyl)-2-[4-[(5-nitro-2-oxopyridin-1-yl)methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: 2-[4-[(2-keto-5-nitro-1-pyridyl)methyl]thiazol-2-yl]-N-(o-tolyl)acetamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)CN3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)CN3C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c1-12-4-2-3-5-15(12)20-16(23)8-17-19-13(11-27-17)9-21-10-14(22(25)26)6-7-18(21)24/h2-7,10-11H,8-9H2,1H3,(H,20,23)