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

Systemtic Name: ethyl 4-[1-(3-methoxypropyl)-5-methyl-4-(2-methylpropylcarbamoyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[4-(isobutylcarbamoyl)-1-(3-methoxypropyl)-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[1-(3-methoxypropyl)-5-methyl-4-[(2-methylpropylamino)-oxomethyl]-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(3-methoxypropyl)-5-methyl-4-(2-methylpropylcarbamoyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[4-(isobutylcarbamoyl)-1-(3-methoxypropyl)-5-methyl-pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CCCOC)C)C(=O)NCC(C)C

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CCCOC)C)C(=O)NCC(C)C

InChI

InChI=1S/C20H29N3O4S/c1-6-27-20(25)19-22-16(12-28-19)17-10-15(18(24)21-11-13(2)3)14(4)23(17)8-7-9-26-5/h10,12-13H,6-9,11H2,1-5H3,(H,21,24)