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

Systemtic Name: ethyl 4-[5-methyl-1-(oxolan-2-ylmethyl)-4-(prop-2-enylcarbamoyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[4-(allylcarbamoyl)-5-methyl-1-(tetrahydrofuran-2-ylmethyl)pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[5-methyl-1-(2-oxolanylmethyl)-4-[oxo-(prop-2-enylamino)methyl]-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-methyl-1-(oxolan-2-ylmethyl)-4-(prop-2-enylcarbamoyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[4-(allylcarbamoyl)-5-methyl-1-(tetrahydrofurfuryl)pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3CCCO3)C)C(=O)NCC=C

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3CCCO3)C)C(=O)NCC=C

InChI

InChI=1S/C20H25N3O4S/c1-4-8-21-18(24)15-10-17(16-12-28-19(22-16)20(25)26-5-2)23(13(15)3)11-14-7-6-9-27-14/h4,10,12,14H,1,5-9,11H2,2-3H3,(H,21,24)