ethyl 2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[(E)-3-(3,4-dichlorophenyl)-1-oxoprop-2-enyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(3,4-dichlorophenyl)acryloyl]amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C20H15Cl2NO3S MolecularWeight: 420.309

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C=CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)/C=C/C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H15Cl2NO3S/c1-2-26-20(25)18-13-5-3-4-6-16(13)27-19(18)23-17(24)10-8-12-7-9-14(21)15(22)11-12/h3-11H,2H2,1H3,(H,23,24)/b10-8+