N-(1,3-benzothiazol-2-yl)-2-(6-methoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(6-methoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[(6-methoxy-3-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(6-methoxy-3-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(6-methoxy-3-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(6-methoxy-3-methyl-2-quinolyl)thio]acetamide Formula: C20H17N3O2S2 MolecularWeight: 395.49788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17N3O2S2/c1-12-9-13-10-14(25-2)7-8-15(13)21-19(12)26-11-18(24)23-20-22-16-5-3-4-6-17(16)27-20/h3-10H,11H2,1-2H3,(H,22,23,24)