ethyl 5-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[(E)-3-[4-[(cyclopropylamino)-oxomethyl]phenyl]-1-oxoprop-2-enyl]amino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]prop-2-enoyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[(E)-3-[4-(cyclopropylcarbamoyl)phenyl]acryloyl]amino]benzothiophene-2-carboxylic acid ethyl ester Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C=CC3=CC=C(C=C3)C(=O)NC4CC4

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4CC4

InChI

InChI=1S/C24H22N2O4S/c1-2-30-24(29)21-14-17-13-19(10-11-20(17)31-21)25-22(27)12-5-15-3-6-16(7-4-15)23(28)26-18-8-9-18/h3-7,10-14,18H,2,8-9H2,1H3,(H,25,27)(H,26,28)/b12-5+