ethyl 4-methyl-5-(4-nitrophenyl)-2-(phenylcarbamoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-(4-nitrophenyl)-2-(phenylcarbamoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(4-nitrophenyl)-2-(phenylcarbamoylamino)thiophene-3-carboxylate CAS Name: 2-[[anilino(oxo)methyl]amino]-4-methyl-5-(4-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(4-nitrophenyl)-2-(phenylcarbamoylamino)thiophene-3-carboxylate Traditional Name: 4-methyl-5-(4-nitrophenyl)-2-(phenylcarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O5S/c1-3-29-20(25)17-13(2)18(14-9-11-16(12-10-14)24(27)28)30-19(17)23-21(26)22-15-7-5-4-6-8-15/h4-12H,3H2,1-2H3,(H2,22,23,26)