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

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[3-(3-methoxy-4-propoxy-phenyl)prop-2-enoylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[3-(3-methoxy-4-propoxy-phenyl)prop-2-enoylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[3-(3-methoxy-4-propoxyphenyl)-1-oxoprop-2-enyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[3-(3-methoxy-4-propoxyphenyl)prop-2-enoylamino]-5-methylthiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[[3-(3-methoxy-4-propoxy-phenyl)acryloyl]amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H28ClNO5S MolecularWeight: 514.03292

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)Cl)C(=O)OCC)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)Cl)C(=O)OCC)OC

InChI

InChI=1S/C27H28ClNO5S/c1-5-15-34-21-13-7-18(16-22(21)32-4)8-14-23(30)29-26-25(27(31)33-6-2)24(17(3)35-26)19-9-11-20(28)12-10-19/h7-14,16H,5-6,15H2,1-4H3,(H,29,30)