N-[4-[2-(6,7-dimethoxy-3-methyl-quinolin-2-yl)sulfanylethanoylamino]phenyl]propanamide

Systemtic Name: N-[4-[2-(6,7-dimethoxy-3-methyl-quinolin-2-yl)sulfanylethanoylamino]phenyl]propanamide Openeye Name: N-[4-[[2-[(6,7-dimethoxy-3-methyl-2-quinolyl)sulfanyl]acetyl]amino]phenyl]propanamide CAS Name: N-[4-[[2-[(6,7-dimethoxy-3-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]phenyl]propanamide IUPAC Name: N-[4-[[2-(6,7-dimethoxy-3-methylquinolin-2-yl)sulfanylacetyl]amino]phenyl]propanamide Traditional Name: N-[4-[[2-[(6,7-dimethoxy-3-methyl-2-quinolyl)thio]acetyl]amino]phenyl]propionamide Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=C(C=C3C=C(C(=CC3=N2)OC)OC)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=C(C=C3C=C(C(=CC3=N2)OC)OC)C

InChI

InChI=1S/C23H25N3O4S/c1-5-21(27)24-16-6-8-17(9-7-16)25-22(28)13-31-23-14(2)10-15-11-19(29-3)20(30-4)12-18(15)26-23/h6-12H,5,13H2,1-4H3,(H,24,27)(H,25,28)