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

Systemtic Name: ethyl 4-[4-(3-methoxypropylcarbamoyl)-5-methyl-1-(thiophen-2-ylmethyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[4-(3-methoxypropylcarbamoyl)-5-methyl-1-(2-thienylmethyl)pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[4-[(3-methoxypropylamino)-oxomethyl]-5-methyl-1-(thiophen-2-ylmethyl)-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-methoxypropylcarbamoyl)-5-methyl-1-(thiophen-2-ylmethyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[4-(3-methoxypropylcarbamoyl)-5-methyl-1-(2-thenyl)pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3=CC=CS3)C)C(=O)NCCCOC

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3=CC=CS3)C)C(=O)NCCCOC

InChI

InChI=1S/C21H25N3O4S2/c1-4-28-21(26)20-23-17(13-30-20)18-11-16(19(25)22-8-6-9-27-3)14(2)24(18)12-15-7-5-10-29-15/h5,7,10-11,13H,4,6,8-9,12H2,1-3H3,(H,22,25)