2-[[2-(1,3-benzothiazol-2-ylsulfanyl)-5-nitro-phenyl]methylidene]propanedinitrile

Systemtic Name: 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)-5-nitro-phenyl]methylidene]propanedinitrile Openeye Name: 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)-5-nitro-phenyl]methylene]propanedinitrile CAS Name: 2-[[2-(1,3-benzothiazol-2-ylthio)-5-nitrophenyl]methylidene]propanedinitrile IUPAC Name: 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)-5-nitrophenyl]methylidene]propanedinitrile Traditional Name: 2-[2-(1,3-benzothiazol-2-ylthio)-5-nitro-benzylidene]malononitrile Formula: C17H8N4O2S2 MolecularWeight: 364.40102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])C=C(C#N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])C=C(C#N)C#N

InChI

InChI=1S/C17H8N4O2S2/c18-9-11(10-19)7-12-8-13(21(22)23)5-6-15(12)24-17-20-14-3-1-2-4-16(14)25-17/h1-8H