N-(6-methyl-1,3-benzothiazol-2-yl)-2-quinolin-2-ylsulfanyl-propanamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-quinolin-2-ylsulfanyl-propanamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(2-quinolylsulfanyl)propanamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(2-quinolinylthio)propanamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-quinolin-2-ylsulfanylpropanamide Traditional Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(2-quinolylthio)propionamide Formula: C20H17N3OS2 MolecularWeight: 379.49848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=NC4=CC=CC=C4C=C3

InChI

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