2-[(2-cyclohexylsulfanyl-5-nitro-phenyl)methylidene]propanedinitrile

Systemtic Name: 2-[(2-cyclohexylsulfanyl-5-nitro-phenyl)methylidene]propanedinitrile Openeye Name: 2-[(2-cyclohexylsulfanyl-5-nitro-phenyl)methylene]propanedinitrile CAS Name: 2-[[2-(cyclohexylthio)-5-nitrophenyl]methylidene]propanedinitrile IUPAC Name: 2-[(2-cyclohexylsulfanyl-5-nitrophenyl)methylidene]propanedinitrile Traditional Name: 2-[2-(cyclohexylthio)-5-nitro-benzylidene]malononitrile Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=C(C=C(C=C2)[N+](=O)[O-])C=C(C#N)C#N

Isomeric SMILES

C1CCC(CC1)SC2=C(C=C(C=C2)[N+](=O)[O-])C=C(C#N)C#N

InChI

InChI=1S/C16H15N3O2S/c17-10-12(11-18)8-13-9-14(19(20)21)6-7-16(13)22-15-4-2-1-3-5-15/h6-9,15H,1-5H2