ethyl 2-[[3-(butanoylamino)phenyl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[[3-(butanoylamino)phenyl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[3-(butanoylamino)benzoyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[[oxo-[3-(1-oxobutylamino)phenyl]methyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(butanoylamino)benzoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3-butyramidobenzoyl)amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC(=C1)C(=O)NC2=NC(=C(S2)C(=O)OCC)C

Isomeric SMILES

CCCC(=O)NC1=CC=CC(=C1)C(=O)NC2=NC(=C(S2)C(=O)OCC)C

InChI

InChI=1S/C18H21N3O4S/c1-4-7-14(22)20-13-9-6-8-12(10-13)16(23)21-18-19-11(3)15(26-18)17(24)25-5-2/h6,8-10H,4-5,7H2,1-3H3,(H,20,22)(H,19,21,23)