2-azanyl-4-methylsulfanyl-6-(4-nitrophenyl)benzene-1,3-dicarbonitrile

Systemtic Name: 2-azanyl-4-methylsulfanyl-6-(4-nitrophenyl)benzene-1,3-dicarbonitrile Openeye Name: 2-amino-4-methylsulfanyl-6-(4-nitrophenyl)benzene-1,3-dicarbonitrile CAS Name: 2-amino-4-(methylthio)-6-(4-nitrophenyl)benzene-1,3-dicarbonitrile IUPAC Name: 2-amino-4-methylsulfanyl-6-(4-nitrophenyl)benzene-1,3-dicarbonitrile Traditional Name: 2-amino-4-(methylthio)-6-(4-nitrophenyl)isophthalonitrile Formula: C15H10N4O2S MolecularWeight: 310.3305

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=C(C(=C1)C2=CC=C(C=C2)[N+](=O)[O-])C#N)N)C#N

Isomeric SMILES

CSC1=C(C(=C(C(=C1)C2=CC=C(C=C2)[N+](=O)[O-])C#N)N)C#N

InChI

InChI=1S/C15H10N4O2S/c1-22-14-6-11(12(7-16)15(18)13(14)8-17)9-2-4-10(5-3-9)19(20)21/h2-6H,18H2,1H3