ethyl 4-[4-aminocarbonyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-pyrrol-2-yl]-1,3-thiazole-2-carboxylate

Systemtic Name: ethyl 4-[4-aminocarbonyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[4-carbamoyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[4-carbamoyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-carbamoyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methylpyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-(4-carbamoyl-1-homoveratryl-5-methyl-pyrrol-2-yl)thiazole-2-carboxylic acid ethyl ester Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CCC3=CC(=C(C=C3)OC)OC)C)C(=O)N

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CCC3=CC(=C(C=C3)OC)OC)C)C(=O)N

InChI

InChI=1S/C22H25N3O5S/c1-5-30-22(27)21-24-16(12-31-21)17-11-15(20(23)26)13(2)25(17)9-8-14-6-7-18(28-3)19(10-14)29-4/h6-7,10-12H,5,8-9H2,1-4H3,(H2,23,26)