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

Systemtic Name: methyl 3-[(2-chlorophenyl)carbamoylamino]-5-(4-ethoxyphenyl)thiophene-2-carboxylate Openeye Name: methyl 3-[(2-chlorophenyl)carbamoylamino]-5-(4-ethoxyphenyl)thiophene-2-carboxylate CAS Name: 3-[[(2-chloroanilino)-oxomethyl]amino]-5-(4-ethoxyphenyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chlorophenyl)carbamoylamino]-5-(4-ethoxyphenyl)thiophene-2-carboxylate Traditional Name: 3-[(2-chlorophenyl)carbamoylamino]-5-p-phenetyl-thiophene-2-carboxylic acid methyl ester Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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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=CC=C3Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=C(S2)C(=O)OC)NC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C21H19ClN2O4S/c1-3-28-14-10-8-13(9-11-14)18-12-17(19(29-18)20(25)27-2)24-21(26)23-16-7-5-4-6-15(16)22/h4-12H,3H2,1-2H3,(H2,23,24,26)