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

Systemtic Name: ethyl 4-[4-(2-ethylhexylcarbamoyl)-1-(3-methoxypropyl)-5-methyl-pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[4-(2-ethylhexylcarbamoyl)-1-(3-methoxypropyl)-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[4-[(2-ethylhexylamino)-oxomethyl]-1-(3-methoxypropyl)-5-methyl-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(2-ethylhexylcarbamoyl)-1-(3-methoxypropyl)-5-methylpyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[4-(2-ethylhexylcarbamoyl)-1-(3-methoxypropyl)-5-methyl-pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C24H37N3O4S MolecularWeight: 463.63328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C(=O)OCC)CCCOC)C

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C(=O)OCC)CCCOC)C

InChI

InChI=1S/C24H37N3O4S/c1-6-9-11-18(7-2)15-25-22(28)19-14-21(27(17(19)4)12-10-13-30-5)20-16-32-23(26-20)24(29)31-8-3/h14,16,18H,6-13,15H2,1-5H3,(H,25,28)