[2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 3-(4-butyl-3-oxidanylidene-quinoxalin-2-yl)propanoate

Systemtic Name: [2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 3-(4-butyl-3-oxidanylidene-quinoxalin-2-yl)propanoate Openeye Name: [2-(4-methoxyanilino)thiazol-4-yl]methyl 3-(4-butyl-3-oxo-quinoxalin-2-yl)propanoate CAS Name: 3-(4-butyl-3-oxo-2-quinoxalinyl)propanoic acid [2-(4-methoxyanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methoxyanilino)-1,3-thiazol-4-yl]methyl 3-(4-butyl-3-oxoquinoxalin-2-yl)propanoate Traditional Name: 3-(4-butyl-3-keto-quinoxalin-2-yl)propionic acid [2-(p-anisidino)thiazol-4-yl]methyl ester Formula: C26H28N4O4S MolecularWeight: 492.58992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=CSC(=N3)NC4=CC=C(C=C4)OC

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=CSC(=N3)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H28N4O4S/c1-3-4-15-30-23-8-6-5-7-21(23)29-22(25(30)32)13-14-24(31)34-16-19-17-35-26(28-19)27-18-9-11-20(33-2)12-10-18/h5-12,17H,3-4,13-16H2,1-2H3,(H,27,28)