ethyl 4-(4-chlorophenyl)-5-methyl-2-[3-(2-propoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-[3-(2-propoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-[3-(2-propoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-5-methyl-2-[[1-oxo-3-(2-propoxyphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-[3-(2-propoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-5-methyl-2-[[3-(2-propoxyphenyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C26H26ClNO4S MolecularWeight: 484.00694

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=CC(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)Cl)C(=O)OCC

Isomeric SMILES

CCCOC1=CC=CC=C1C=CC(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)Cl)C(=O)OCC

InChI

InChI=1S/C26H26ClNO4S/c1-4-16-32-21-9-7-6-8-18(21)12-15-22(29)28-25-24(26(30)31-5-2)23(17(3)33-25)19-10-13-20(27)14-11-19/h6-15H,4-5,16H2,1-3H3,(H,28,29)