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

Systemtic Name: ethyl 2-[[3-(2-ethylbutanoylamino)phenyl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[3-(2-ethylbutanoylamino)benzoyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[[3-[(2-ethyl-1-oxobutyl)amino]phenyl]-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(2-ethylbutanoylamino)benzoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[3-(2-ethylbutanoylamino)benzoyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S/c1-5-13(6-2)17(24)22-15-10-8-9-14(11-15)18(25)23-20-21-12(4)16(28-20)19(26)27-7-3/h8-11,13H,5-7H2,1-4H3,(H,22,24)(H,21,23,25)