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

Systemtic Name: ethyl 2-[3-(3-chlorophenyl)prop-2-enoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(3-chlorophenyl)prop-2-enoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[3-(3-chlorophenyl)-1-oxoprop-2-enyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(3-chlorophenyl)prop-2-enoylamino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[3-(3-chlorophenyl)acryloyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H20ClNO3S MolecularWeight: 425.9278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C=CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C=CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H20ClNO3S/c1-3-28-23(27)21-20(17-9-5-4-6-10-17)15(2)29-22(21)25-19(26)13-12-16-8-7-11-18(24)14-16/h4-14H,3H2,1-2H3,(H,25,26)