3-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-methylphenyl)propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-methylphenyl)propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(p-tolyl)propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(4-methylphenyl)propanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-methylphenyl)propanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(p-tolyl)propionamide Formula: C17H16N2OS2 MolecularWeight: 328.45174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H16N2OS2/c1-12-6-8-13(9-7-12)18-16(20)10-11-21-17-19-14-4-2-3-5-15(14)22-17/h2-9H,10-11H2,1H3,(H,18,20)