ethyl 4-[2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylethanoylamino]butanoate Openeye Name: ethyl 4-[[2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]acetyl]amino]butanoate CAS Name: 4-[[2-[(7-methoxy-4-phenyl-2-quinolinyl)thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(7-methoxy-4-phenylquinolin-2-yl)sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(7-methoxy-4-phenyl-2-quinolyl)thio]acetyl]amino]butyric acid ethyl ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NC2=C(C=CC(=C2)OC)C(=C1)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NC2=C(C=CC(=C2)OC)C(=C1)C3=CC=CC=C3

InChI

InChI=1S/C24H26N2O4S/c1-3-30-24(28)10-7-13-25-22(27)16-31-23-15-20(17-8-5-4-6-9-17)19-12-11-18(29-2)14-21(19)26-23/h4-6,8-9,11-12,14-15H,3,7,10,13,16H2,1-2H3,(H,25,27)