ethyl 2-[[2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[[2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[[(4-ethoxyphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4-ethoxybenzoyl)amino]-3-methylbutanoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC2=NC(=C(S2)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC2=NC(=C(S2)C(=O)OCC)C

InChI

InChI=1S/C21H27N3O5S/c1-6-28-15-10-8-14(9-11-15)18(25)23-16(12(3)4)19(26)24-21-22-13(5)17(30-21)20(27)29-7-2/h8-12,16H,6-7H2,1-5H3,(H,23,25)(H,22,24,26)