N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-quinolin-2-ylsulfanyl-propanamide

Systemtic Name: N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-quinolin-2-ylsulfanyl-propanamide Openeye Name: N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-2-(2-quinolylsulfanyl)propanamide CAS Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-(2-quinolinylthio)propanamide IUPAC Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-quinolin-2-ylsulfanylpropanamide Traditional Name: N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-2-(2-quinolylthio)propionamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C(C)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C(C)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H23N3O2S/c1-14-7-6-8-15(2)21(14)25-19(26)13-23-22(27)16(3)28-20-12-11-17-9-4-5-10-18(17)24-20/h4-12,16H,13H2,1-3H3,(H,23,27)(H,25,26)