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N-[4-(5-methylsulfanylpentylamino)quinolin-3-yl]heptanamide

N-[4-(5-methylsulfanylpentylamino)quinolin-3-yl]heptanamide

Systemtic Name:N-[4-(5-methylsulfanylpentylamino)quinolin-3-yl]heptanamide
Openeye Name:N-[4-(5-methylsulfanylpentylamino)-3-quinolyl]heptanamide
CAS Name:N-[4-[5-(methylthio)pentylamino]-3-quinolinyl]heptanamide
IUPAC Name:N-[4-(5-methylsulfanylpentylamino)quinolin-3-yl]heptanamide
Traditional Name:N-[4-[5-(methylthio)pentylamino]-3-quinolyl]enanthamide
Formula: C22H33N3OS
MolecularWeight: 387.58192
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=C(C2=CC=CC=C2N=C1)NCCCCCSC


Isomeric SMILES

CCCCCCC(=O)NC1=C(C2=CC=CC=C2N=C1)NCCCCCSC


InChI

InChI=1S/C22H33N3OS/c1-3-4-5-7-14-21(26)25-20-17-24-19-13-9-8-12-18(19)22(20)23-15-10-6-11-16-27-2/h8-9,12-13,17H,3-7,10-11,14-16H2,1-2H3,(H,23,24)(H,25,26)


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