N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-[(1-phenyltetrazol-5-yl)thio]acetamide Formula: C17H14N6OS3 MolecularWeight: 414.52766

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H14N6OS3/c1-25-17-19-13-8-7-11(9-14(13)27-17)18-15(24)10-26-16-20-21-22-23(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,24)