N-[5-(2-hexyldecanethioylamino)-6-methoxy-quinolin-8-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[5-(2-hexyldecanethioylamino)-6-methoxy-quinolin-8-yl]-2,2-dimethyl-propanamide Openeye Name: N-[5-(2-hexyldecanethioylamino)-6-methoxy-8-quinolyl]-2,2-dimethyl-propanamide CAS Name: N-[5-[(2-hexyl-1-sulfanylidenedecyl)amino]-6-methoxy-8-quinolinyl]-2,2-dimethylpropanamide IUPAC Name: N-[5-(2-hexyldecanethioylamino)-6-methoxyquinolin-8-yl]-2,2-dimethylpropanamide Traditional Name: N-[5-(2-hexyldecanethioylamino)-6-methoxy-8-quinolyl]-2,2-dimethyl-propionamide Formula: C31H49N3O2S MolecularWeight: 527.80466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCC)C(=S)NC1=C(C=C(C2=C1C=CC=N2)NC(=O)C(C)(C)C)OC

Isomeric SMILES

CCCCCCCCC(CCCCCC)C(=S)NC1=C(C=C(C2=C1C=CC=N2)NC(=O)C(C)(C)C)OC

InChI

InChI=1S/C31H49N3O2S/c1-7-9-11-13-14-16-19-23(18-15-12-10-8-2)29(37)34-28-24-20-17-21-32-27(24)25(22-26(28)36-6)33-30(35)31(3,4)5/h17,20-23H,7-16,18-19H2,1-6H3,(H,33,35)(H,34,37)