propan-2-yl 5-methyl-2-[(5-nitrofuran-2-yl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: propan-2-yl 5-methyl-2-[(5-nitrofuran-2-yl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: isopropyl 5-methyl-2-[(5-nitrofuran-2-carbonyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[(5-nitro-2-furanyl)-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-methyl-2-[(5-nitrofuran-2-carbonyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-methyl-2-[(5-nitro-2-furoyl)amino]-4-phenyl-thiophene-3-carboxylic acid isopropyl ester Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C(=O)OC(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C(=O)OC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C20H18N2O6S/c1-11(2)27-20(24)17-16(13-7-5-4-6-8-13)12(3)29-19(17)21-18(23)14-9-10-15(28-14)22(25)26/h4-11H,1-3H3,(H,21,23)