N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-phenylsulfanyl-butanamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-phenylsulfanyl-butanamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-4-(phenylthio)butanamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-phenylsulfanylbutanamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-4-(phenylthio)butyramide Formula: C18H18N2OS3 MolecularWeight: 374.54332

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C18H18N2OS3/c1-22-18-20-15-10-9-13(12-16(15)24-18)19-17(21)8-5-11-23-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,19,21)