N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(8-quinolylsulfanyl)acetamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(8-quinolinylthio)acetamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(8-quinolylthio)acetamide Formula: C20H17N3OS2 MolecularWeight: 379.49848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CSC3=CC=CC4=C3N=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CSC3=CC=CC4=C3N=CC=C4)C

InChI

InChI=1S/C20H17N3OS2/c1-12-9-13(2)18-16(10-12)26-20(23-18)22-17(24)11-25-15-7-3-5-14-6-4-8-21-19(14)15/h3-10H,11H2,1-2H3,(H,22,23,24)