methyl 4-cyano-5-[2-(3,4-dimethoxyphenyl)ethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-5-[2-(3,4-dimethoxyphenyl)ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-(homoveratroylamino)-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CC2=CC(=C(C=C2)OC)OC)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CC2=CC(=C(C=C2)OC)OC)C(=O)OC

InChI

InChI=1S/C18H18N2O5S/c1-10-12(9-19)17(26-16(10)18(22)25-4)20-15(21)8-11-5-6-13(23-2)14(7-11)24-3/h5-7H,8H2,1-4H3,(H,20,21)