N-(4-butylphenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(4-butylphenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide Openeye Name: N-(4-butylphenyl)-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-(4-butylphenyl)-2-[(4,6,8-trimethyl-2-quinolinyl)thio]butanamide IUPAC Name: N-(4-butylphenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-(4-butylphenyl)-2-[(4,6,8-trimethyl-2-quinolyl)thio]butyramide Formula: C26H32N2OS MolecularWeight: 420.61008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2OS/c1-6-8-9-20-10-12-21(13-11-20)27-26(29)23(7-2)30-24-16-18(4)22-15-17(3)14-19(5)25(22)28-24/h10-16,23H,6-9H2,1-5H3,(H,27,29)