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

Systemtic Name: ethyl 4-[4-(cyclohexylmethylcarbamoyl)-5-methyl-1-(2-methylpropyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[4-(cyclohexylmethylcarbamoyl)-1-isobutyl-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[4-[(cyclohexylmethylamino)-oxomethyl]-5-methyl-1-(2-methylpropyl)-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(cyclohexylmethylcarbamoyl)-5-methyl-1-(2-methylpropyl)pyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[4-(cyclohexylmethylcarbamoyl)-1-isobutyl-5-methyl-pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC(C)C)C)C(=O)NCC3CCCCC3

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC(C)C)C)C(=O)NCC3CCCCC3

InChI

InChI=1S/C23H33N3O3S/c1-5-29-23(28)22-25-19(14-30-22)20-11-18(16(4)26(20)13-15(2)3)21(27)24-12-17-9-7-6-8-10-17/h11,14-15,17H,5-10,12-13H2,1-4H3,(H,24,27)