N-(4-phenyl-1,3-thiazol-2-yl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(4-phenyl-1,3-thiazol-2-yl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide Openeye Name: N-(4-phenylthiazol-2-yl)-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-(4-phenyl-2-thiazolyl)-2-[(4,6,8-trimethyl-2-quinolinyl)thio]butanamide IUPAC Name: N-(4-phenyl-1,3-thiazol-2-yl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-(4-phenylthiazol-2-yl)-2-[(4,6,8-trimethyl-2-quinolyl)thio]butyramide Formula: C25H25N3OS2 MolecularWeight: 447.6155

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3OS2/c1-5-21(24(29)28-25-26-20(14-30-25)18-9-7-6-8-10-18)31-22-13-16(3)19-12-15(2)11-17(4)23(19)27-22/h6-14,21H,5H2,1-4H3,(H,26,28,29)