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

Systemtic Name: ethyl 4-[4-(cyclohexylmethylcarbamoyl)-1-(furan-2-ylmethyl)-5-methyl-pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[4-(cyclohexylmethylcarbamoyl)-1-(2-furylmethyl)-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[4-[(cyclohexylmethylamino)-oxomethyl]-1-(2-furanylmethyl)-5-methyl-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(cyclohexylmethylcarbamoyl)-1-(furan-2-ylmethyl)-5-methylpyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[4-(cyclohexylmethylcarbamoyl)-1-(2-furfuryl)-5-methyl-pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3=CC=CO3)C)C(=O)NCC4CCCCC4

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CC3=CC=CO3)C)C(=O)NCC4CCCCC4

InChI

InChI=1S/C24H29N3O4S/c1-3-30-24(29)23-26-20(15-32-23)21-12-19(16(2)27(21)14-18-10-7-11-31-18)22(28)25-13-17-8-5-4-6-9-17/h7,10-12,15,17H,3-6,8-9,13-14H2,1-2H3,(H,25,28)