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

Systemtic Name: methyl 2-[(3-chlorophenyl)carbamoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(3-chlorophenyl)carbamoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[(3-chloroanilino)-oxomethyl]amino]-4-(4-ethylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-chlorophenyl)carbamoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(3-chlorophenyl)carbamoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H19ClN2O3S/c1-3-13-7-9-14(10-8-13)17-12-28-19(18(17)20(25)27-2)24-21(26)23-16-6-4-5-15(22)11-16/h4-12H,3H2,1-2H3,(H2,23,24,26)