ethyl 2-(2-chloranylethanoylamino)-4-(3,4-dimethoxyphenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-chloranylethanoylamino)-4-(3,4-dimethoxyphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-chloroacetyl)amino]-4-(3,4-dimethoxyphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[(2-chloro-1-oxoethyl)amino]-4-(3,4-dimethoxyphenyl)-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloroacetyl)amino]-4-(3,4-dimethoxyphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[(2-chloroacetyl)amino]-4-(3,4-dimethoxyphenyl)-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H20ClNO5S MolecularWeight: 397.8731

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)OC)OC)C)NC(=O)CCl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)OC)OC)C)NC(=O)CCl

InChI

InChI=1S/C18H20ClNO5S/c1-5-25-18(22)16-15(10(2)26-17(16)20-14(21)9-19)11-6-7-12(23-3)13(8-11)24-4/h6-8H,5,9H2,1-4H3,(H,20,21)