N-(1,3-benzothiazol-2-yl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-benzylsulfanyl-propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-(phenylmethylthio)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-benzylsulfanylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-(benzylthio)propionamide Formula: C17H16N2OS2 MolecularWeight: 328.45174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)CSCCC(=O)NC2=NC3=CC=CC=C3S2

InChI

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