methyl 2-[[(E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-1-oxo-3-(2-propoxyphenyl)prop-2-enyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(2-propoxyphenyl)acryloyl]amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=C(C#N)C(=O)NC2=C(C=C(S2)C)C(=O)OC

Isomeric SMILES

CCCOC1=CC=CC=C1/C=C(\C#N)/C(=O)NC2=C(C=C(S2)C)C(=O)OC

InChI

InChI=1S/C20H20N2O4S/c1-4-9-26-17-8-6-5-7-14(17)11-15(12-21)18(23)22-19-16(20(24)25-3)10-13(2)27-19/h5-8,10-11H,4,9H2,1-3H3,(H,22,23)/b15-11+