ethyl 4-[1-(5-acetamido-6-methoxy-6-oxidanylidene-hexyl)-4-aminocarbonyl-5-methyl-pyrrol-2-yl]-1,3-thiazole-2-carboxylate

Systemtic Name: ethyl 4-[1-(5-acetamido-6-methoxy-6-oxidanylidene-hexyl)-4-aminocarbonyl-5-methyl-pyrrol-2-yl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[1-(5-acetamido-6-methoxy-6-oxo-hexyl)-4-carbamoyl-5-methyl-pyrrol-2-yl]thiazole-2-carboxylate CAS Name: 4-[1-(5-acetamido-6-methoxy-6-oxohexyl)-4-carbamoyl-5-methyl-2-pyrrolyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(5-acetamido-6-methoxy-6-oxohexyl)-4-carbamoyl-5-methylpyrrol-2-yl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[1-(5-acetamido-6-keto-6-methoxy-hexyl)-4-carbamoyl-5-methyl-pyrrol-2-yl]thiazole-2-carboxylic acid ethyl ester Formula: C21H28N4O6S MolecularWeight: 464.53522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CCCCC(C(=O)OC)NC(=O)C)C)C(=O)N

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C2=CC(=C(N2CCCCC(C(=O)OC)NC(=O)C)C)C(=O)N

InChI

InChI=1S/C21H28N4O6S/c1-5-31-21(29)19-24-16(11-32-19)17-10-14(18(22)27)12(2)25(17)9-7-6-8-15(20(28)30-4)23-13(3)26/h10-11,15H,5-9H2,1-4H3,(H2,22,27)(H,23,26)