ethyl 4-[5-methyl-1-(2-methylpropyl)-4-(prop-2-enylcarbamoyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate

Systemtic Name: ethyl 4-[5-methyl-1-(2-methylpropyl)-4-(prop-2-enylcarbamoyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[4-(allylcarbamoyl)-1-isobutyl-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[5-methyl-1-(2-methylpropyl)-4-[oxo-(prop-2-enylamino)methyl]-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-methyl-1-(2-methylpropyl)-4-(prop-2-enylcarbamoyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[4-(allylcarbamoyl)-1-isobutyl-5-methyl-pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC(C)C)C)C(=O)NCC=C

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC(C)C)C)C(=O)NCC=C

InChI

InChI=1S/C19H25N3O3S/c1-6-8-20-17(23)14-9-16(22(13(14)5)10-12(3)4)15-11-26-18(21-15)19(24)25-7-2/h6,9,11-12H,1,7-8,10H2,2-5H3,(H,20,23)