N-[5-(1,3-benzothiazol-2-yl)-5-cyano-4-methylsulfanyl-pent-4-enyl]ethanamide

Systemtic Name: N-[5-(1,3-benzothiazol-2-yl)-5-cyano-4-methylsulfanyl-pent-4-enyl]ethanamide Openeye Name: N-[5-(1,3-benzothiazol-2-yl)-5-cyano-4-methylsulfanyl-pent-4-enyl]acetamide CAS Name: N-[5-(1,3-benzothiazol-2-yl)-5-cyano-4-(methylthio)pent-4-enyl]acetamide IUPAC Name: N-[5-(1,3-benzothiazol-2-yl)-5-cyano-4-methylsulfanylpent-4-enyl]acetamide Traditional Name: N-[5-(1,3-benzothiazol-2-yl)-5-cyano-4-(methylthio)pent-4-enyl]acetamide Formula: C16H17N3OS2 MolecularWeight: 331.45568

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC(=C(C#N)C1=NC2=CC=CC=C2S1)SC

Isomeric SMILES

CC(=O)NCCCC(=C(C#N)C1=NC2=CC=CC=C2S1)SC

InChI

InChI=1S/C16H17N3OS2/c1-11(20)18-9-5-8-14(21-2)12(10-17)16-19-13-6-3-4-7-15(13)22-16/h3-4,6-7H,5,8-9H2,1-2H3,(H,18,20)