N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-quinolin-2-ylsulfanyl-butanamide

Systemtic Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-quinolin-2-ylsulfanyl-butanamide Openeye Name: N-[4-(p-tolyl)thiazol-2-yl]-2-(2-quinolylsulfanyl)butanamide CAS Name: N-[4-(4-methylphenyl)-2-thiazolyl]-2-(2-quinolinylthio)butanamide IUPAC Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-quinolin-2-ylsulfanylbutanamide Traditional Name: N-[4-(p-tolyl)thiazol-2-yl]-2-(2-quinolylthio)butyramide Formula: C23H21N3OS2 MolecularWeight: 419.56234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)C)SC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)C)SC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H21N3OS2/c1-3-20(29-21-13-12-16-6-4-5-7-18(16)24-21)22(27)26-23-25-19(14-28-23)17-10-8-15(2)9-11-17/h4-14,20H,3H2,1-2H3,(H,25,26,27)