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

Systemtic Name: N-[5-[2-(3-ethyl-8-methyl-quinolin-2-yl)sulfanylethanoylamino]-2-methyl-phenyl]propanamide Openeye Name: N-[5-[[2-[(3-ethyl-8-methyl-2-quinolyl)sulfanyl]acetyl]amino]-2-methyl-phenyl]propanamide CAS Name: N-[5-[[2-[(3-ethyl-8-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]-2-methylphenyl]propanamide IUPAC Name: N-[5-[[2-(3-ethyl-8-methylquinolin-2-yl)sulfanylacetyl]amino]-2-methylphenyl]propanamide Traditional Name: N-[5-[[2-[(3-ethyl-8-methyl-2-quinolyl)thio]acetyl]amino]-2-methyl-phenyl]propionamide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O2S/c1-5-17-12-18-9-7-8-16(4)23(18)27-24(17)30-14-22(29)25-19-11-10-15(3)20(13-19)26-21(28)6-2/h7-13H,5-6,14H2,1-4H3,(H,25,29)(H,26,28)