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

Systemtic Name: ethyl 4-[1-(cyclohexylmethyl)-4-(cyclohexylmethylcarbamoyl)-5-methyl-pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[1-(cyclohexylmethyl)-4-(cyclohexylmethylcarbamoyl)-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[1-(cyclohexylmethyl)-4-[(cyclohexylmethylamino)-oxomethyl]-5-methyl-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(cyclohexylmethyl)-4-(cyclohexylmethylcarbamoyl)-5-methylpyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[1-(cyclohexylmethyl)-4-(cyclohexylmethylcarbamoyl)-5-methyl-pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C26H37N3O3S MolecularWeight: 471.65528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3CCCCC3)C)C(=O)NCC4CCCCC4

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3CCCCC3)C)C(=O)NCC4CCCCC4

InChI

InChI=1S/C26H37N3O3S/c1-3-32-26(31)25-28-22(17-33-25)23-14-21(24(30)27-15-19-10-6-4-7-11-19)18(2)29(23)16-20-12-8-5-9-13-20/h14,17,19-20H,3-13,15-16H2,1-2H3,(H,27,30)