N-(4-butylphenyl)-2-quinolin-2-ylsulfanyl-butanamide

Systemtic Name: N-(4-butylphenyl)-2-quinolin-2-ylsulfanyl-butanamide Openeye Name: N-(4-butylphenyl)-2-(2-quinolylsulfanyl)butanamide CAS Name: N-(4-butylphenyl)-2-(2-quinolinylthio)butanamide IUPAC Name: N-(4-butylphenyl)-2-quinolin-2-ylsulfanylbutanamide Traditional Name: N-(4-butylphenyl)-2-(2-quinolylthio)butyramide Formula: C23H26N2OS MolecularWeight: 378.53034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(CC)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C(CC)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H26N2OS/c1-3-5-8-17-11-14-19(15-12-17)24-23(26)21(4-2)27-22-16-13-18-9-6-7-10-20(18)25-22/h6-7,9-16,21H,3-5,8H2,1-2H3,(H,24,26)