ethyl 2-[(5-methyl-4-nitro-1,2-oxazol-3-yl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-methyl-4-nitro-1,2-oxazol-3-yl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-methyl-4-nitro-isoxazole-3-carbonyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(5-methyl-4-nitro-3-isoxazolyl)-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-methyl-4-nitro-1,2-oxazole-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(5-methyl-4-nitro-isoxazole-3-carbonyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H15N3O6S MolecularWeight: 401.3932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=NOC(=C3[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=NOC(=C3[N+](=O)[O-])C

InChI

InChI=1S/C18H15N3O6S/c1-3-26-18(23)13-12(11-7-5-4-6-8-11)9-28-17(13)19-16(22)14-15(21(24)25)10(2)27-20-14/h4-9H,3H2,1-2H3,(H,19,22)