ethyl 3-[[4-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)phenyl]methyl-pentanoyl-amino]benzoate

Systemtic Name: ethyl 3-[[4-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)phenyl]methyl-pentanoyl-amino]benzoate Openeye Name: ethyl 3-[[4-(2-amino-4-oxo-thiazol-5-yl)phenyl]methyl-pentanoyl-amino]benzoate CAS Name: 3-[[4-(2-amino-4-oxo-5-thiazolyl)phenyl]methyl-(1-oxopentyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(2-amino-4-oxo-1,3-thiazol-5-yl)phenyl]methyl-pentanoylamino]benzoate Traditional Name: 3-[[4-(2-amino-4-keto-2-thiazolin-5-yl)benzyl]-valeryl-amino]benzoic acid ethyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC=C(C=C1)C2C(=O)N=C(S2)N)C3=CC=CC(=C3)C(=O)OCC

Isomeric SMILES

CCCCC(=O)N(CC1=CC=C(C=C1)C2C(=O)N=C(S2)N)C3=CC=CC(=C3)C(=O)OCC

InChI

InChI=1S/C24H27N3O4S/c1-3-5-9-20(28)27(19-8-6-7-18(14-19)23(30)31-4-2)15-16-10-12-17(13-11-16)21-22(29)26-24(25)32-21/h6-8,10-14,21H,3-5,9,15H2,1-2H3,(H2,25,26,29)