N-(1,3-benzothiazol-6-yl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(1,3-benzothiazol-6-yl)-4-phenylsulfanyl-butanamide Openeye Name: N-(1,3-benzothiazol-6-yl)-4-phenylsulfanyl-butanamide CAS Name: N-(1,3-benzothiazol-6-yl)-4-(phenylthio)butanamide IUPAC Name: N-(1,3-benzothiazol-6-yl)-4-phenylsulfanylbutanamide Traditional Name: N-(1,3-benzothiazol-6-yl)-4-(phenylthio)butyramide Formula: C17H16N2OS2 MolecularWeight: 328.45174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCC(=O)NC2=CC3=C(C=C2)N=CS3

Isomeric SMILES

C1=CC=C(C=C1)SCCCC(=O)NC2=CC3=C(C=C2)N=CS3

InChI

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