N-[2-methyl-4-[2-(3-methylquinolin-2-yl)sulfanylethanoylamino]phenyl]propanamide

Systemtic Name: N-[2-methyl-4-[2-(3-methylquinolin-2-yl)sulfanylethanoylamino]phenyl]propanamide Openeye Name: N-[2-methyl-4-[[2-[(3-methyl-2-quinolyl)sulfanyl]acetyl]amino]phenyl]propanamide CAS Name: N-[2-methyl-4-[[2-[(3-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]phenyl]propanamide IUPAC Name: N-[2-methyl-4-[[2-(3-methylquinolin-2-yl)sulfanylacetyl]amino]phenyl]propanamide Traditional Name: N-[2-methyl-4-[[2-[(3-methyl-2-quinolyl)thio]acetyl]amino]phenyl]propionamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2C)C

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2C)C

InChI

InChI=1S/C22H23N3O2S/c1-4-20(26)24-18-10-9-17(12-14(18)2)23-21(27)13-28-22-15(3)11-16-7-5-6-8-19(16)25-22/h5-12H,4,13H2,1-3H3,(H,23,27)(H,24,26)