6-ethyl-2-[[(E)-3-phenylprop-2-enoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid

Systemtic Name: 6-ethyl-2-[[(E)-3-phenylprop-2-enoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Openeye Name: 6-ethyl-2-[[(E)-3-phenylprop-2-enoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid CAS Name: 6-ethyl-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid IUPAC Name: 6-ethyl-2-[[(E)-3-phenylprop-2-enoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Traditional Name: 6-ethyl-2-[[(E)-3-phenylacryloyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C1)SC(=C2C(=O)O)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCN1CCC2=C(C1)SC(=C2C(=O)O)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H20N2O3S/c1-2-21-11-10-14-15(12-21)25-18(17(14)19(23)24)20-16(22)9-8-13-6-4-3-5-7-13/h3-9H,2,10-12H2,1H3,(H,20,22)(H,23,24)/b9-8+