3-(1,3-benzothiazol-2-ylsulfanyl)-N-(phenylmethyl)propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(phenylmethyl)propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-benzyl-propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(phenylmethyl)propanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-benzylpropanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-benzyl-propionamide Formula: C17H16N2OS2 MolecularWeight: 328.45174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H16N2OS2/c20-16(18-12-13-6-2-1-3-7-13)10-11-21-17-19-14-8-4-5-9-15(14)22-17/h1-9H,10-12H2,(H,18,20)