N-[5-[2-(3-ethyl-7,8-dimethyl-quinolin-2-yl)sulfanylethanoylamino]-2-methyl-phenyl]propanamide

Systemtic Name: N-[5-[2-(3-ethyl-7,8-dimethyl-quinolin-2-yl)sulfanylethanoylamino]-2-methyl-phenyl]propanamide Openeye Name: N-[5-[[2-[(3-ethyl-7,8-dimethyl-2-quinolyl)sulfanyl]acetyl]amino]-2-methyl-phenyl]propanamide CAS Name: N-[5-[[2-[(3-ethyl-7,8-dimethyl-2-quinolinyl)thio]-1-oxoethyl]amino]-2-methylphenyl]propanamide IUPAC Name: N-[5-[[2-(3-ethyl-7,8-dimethylquinolin-2-yl)sulfanylacetyl]amino]-2-methylphenyl]propanamide Traditional Name: N-[5-[[2-[(3-ethyl-7,8-dimethyl-2-quinolyl)thio]acetyl]amino]-2-methyl-phenyl]propionamide Formula: C25H29N3O2S MolecularWeight: 435.58166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C(=C(C=CC2=C1)C)C)SCC(=O)NC3=CC(=C(C=C3)C)NC(=O)CC

Isomeric SMILES

CCC1=C(N=C2C(=C(C=CC2=C1)C)C)SCC(=O)NC3=CC(=C(C=C3)C)NC(=O)CC

InChI

InChI=1S/C25H29N3O2S/c1-6-18-12-19-10-8-15(3)17(5)24(19)28-25(18)31-14-23(30)26-20-11-9-16(4)21(13-20)27-22(29)7-2/h8-13H,6-7,14H2,1-5H3,(H,26,30)(H,27,29)