propan-2-yl 4-(4-bromophenyl)-2-[(3-ethoxyphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: propan-2-yl 4-(4-bromophenyl)-2-[(3-ethoxyphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: isopropyl 4-(4-bromophenyl)-2-[(3-ethoxybenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(3-ethoxyphenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(4-bromophenyl)-2-[(3-ethoxybenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[(3-ethoxybenzoyl)amino]thiophene-3-carboxylic acid isopropyl ester Formula: C23H22BrNO4S MolecularWeight: 488.39408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OC(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OC(C)C

InChI

InChI=1S/C23H22BrNO4S/c1-4-28-18-7-5-6-16(12-18)21(26)25-22-20(23(27)29-14(2)3)19(13-30-22)15-8-10-17(24)11-9-15/h5-14H,4H2,1-3H3,(H,25,26)