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

Systemtic Name: ethyl 4-[4-(cyclohexylmethylcarbamoyl)-1-[(4-methoxyphenyl)methyl]-5-methyl-pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[4-(cyclohexylmethylcarbamoyl)-1-[(4-methoxyphenyl)methyl]-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[4-[(cyclohexylmethylamino)-oxomethyl]-1-[(4-methoxyphenyl)methyl]-5-methyl-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(cyclohexylmethylcarbamoyl)-1-[(4-methoxyphenyl)methyl]-5-methylpyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[4-(cyclohexylmethylcarbamoyl)-5-methyl-1-p-anisyl-pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C27H33N3O4S MolecularWeight: 495.63362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3=CC=C(C=C3)OC)C)C(=O)NCC4CCCCC4

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3=CC=C(C=C3)OC)C)C(=O)NCC4CCCCC4

InChI

InChI=1S/C27H33N3O4S/c1-4-34-27(32)26-29-23(17-35-26)24-14-22(25(31)28-15-19-8-6-5-7-9-19)18(2)30(24)16-20-10-12-21(33-3)13-11-20/h10-14,17,19H,4-9,15-16H2,1-3H3,(H,28,31)