methyl 4-cyano-5-[3-(4-methoxyphenyl)propanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-5-[3-(4-methoxyphenyl)propanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-[3-(4-methoxyphenyl)propanoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-[3-(4-methoxyphenyl)propanoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[3-(4-methoxyphenyl)propanoylamino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CCC2=CC=C(C=C2)OC)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CCC2=CC=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C18H18N2O4S/c1-11-14(10-19)17(25-16(11)18(22)24-3)20-15(21)9-6-12-4-7-13(23-2)8-5-12/h4-5,7-8H,6,9H2,1-3H3,(H,20,21)