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

Systemtic Name: ethyl 4-[1-butyl-4-(3-methoxypropylcarbamoyl)-5-methyl-pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[1-butyl-4-(3-methoxypropylcarbamoyl)-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[1-butyl-4-[(3-methoxypropylamino)-oxomethyl]-5-methyl-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-butyl-4-(3-methoxypropylcarbamoyl)-5-methylpyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[1-butyl-4-(3-methoxypropylcarbamoyl)-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:

CCCCN1C(=C(C=C1C2=CSC(=N2)C(=O)OCC)C(=O)NCCCOC)C

Isomeric SMILES

CCCCN1C(=C(C=C1C2=CSC(=N2)C(=O)OCC)C(=O)NCCCOC)C

InChI

InChI=1S/C20H29N3O4S/c1-5-7-10-23-14(3)15(18(24)21-9-8-11-26-4)12-17(23)16-13-28-19(22-16)20(25)27-6-2/h12-13H,5-11H2,1-4H3,(H,21,24)