dimethyl 2-[[(Z)-2-cyano-3-phenyl-prop-2-enoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate

Systemtic Name: dimethyl 2-[[(Z)-2-cyano-3-phenyl-prop-2-enoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Openeye Name: dimethyl 2-[[(Z)-2-cyano-3-phenyl-prop-2-enoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate CAS Name: 2-[[(Z)-2-cyano-1-oxo-3-phenylprop-2-enyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[(Z)-2-cyano-3-phenylprop-2-enoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Traditional Name: 2-[[(Z)-2-cyano-3-phenyl-acryloyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC2=C1C(=C(S2)NC(=O)C(=CC3=CC=CC=C3)C#N)C(=O)OC

Isomeric SMILES

COC(=O)C1CCC2=C1C(=C(S2)NC(=O)/C(=C\C3=CC=CC=C3)/C#N)C(=O)OC

InChI

InChI=1S/C21H18N2O5S/c1-27-20(25)14-8-9-15-16(14)17(21(26)28-2)19(29-15)23-18(24)13(11-22)10-12-6-4-3-5-7-12/h3-7,10,14H,8-9H2,1-2H3,(H,23,24)/b13-10-