2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-1-(1-benzotriazolyl)propan-2-ylideneamino]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]acetamide Formula: C18H16N6OS2 MolecularWeight: 396.48924

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CSC1=NC2=CC=CC=C2S1)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C/C(=N\NC(=O)CSC1=NC2=CC=CC=C2S1)/CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H16N6OS2/c1-12(10-24-15-8-4-2-6-13(15)21-23-24)20-22-17(25)11-26-18-19-14-7-3-5-9-16(14)27-18/h2-9H,10-11H2,1H3,(H,22,25)/b20-12+