methyl 5-(4-ethoxyphenyl)-3-[(4-fluorophenyl)carbamoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-(4-ethoxyphenyl)-3-[(4-fluorophenyl)carbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-(4-ethoxyphenyl)-3-[(4-fluorophenyl)carbamoylamino]thiophene-2-carboxylate CAS Name: 5-(4-ethoxyphenyl)-3-[[(4-fluoroanilino)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-ethoxyphenyl)-3-[(4-fluorophenyl)carbamoylamino]thiophene-2-carboxylate Traditional Name: 3-[(4-fluorophenyl)carbamoylamino]-5-p-phenetyl-thiophene-2-carboxylic acid methyl ester Formula: C21H19FN2O4S MolecularWeight: 414.449963

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=C(S2)C(=O)OC)NC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=C(S2)C(=O)OC)NC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FN2O4S/c1-3-28-16-10-4-13(5-11-16)18-12-17(19(29-18)20(25)27-2)24-21(26)23-15-8-6-14(22)7-9-15/h4-12H,3H2,1-2H3,(H2,23,24,26)