N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(3,7-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(3,7-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-2-[(3,7-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-2-[(3,7-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(3,7-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-2-[(3,7-dimethyl-2-quinolyl)thio]acetamide Formula: C20H23N3OS2 MolecularWeight: 385.54612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C)SCC(=O)NC3=NC(=CS3)C(C)(C)C

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C)SCC(=O)NC3=NC(=CS3)C(C)(C)C

InChI

InChI=1S/C20H23N3OS2/c1-12-6-7-14-9-13(2)18(21-15(14)8-12)25-11-17(24)23-19-22-16(10-26-19)20(3,4)5/h6-10H,11H2,1-5H3,(H,22,23,24)