4-nitro-5-quinolin-2-ylsulfanyl-benzene-1,2-dicarbonitrile

Systemtic Name: 4-nitro-5-quinolin-2-ylsulfanyl-benzene-1,2-dicarbonitrile Openeye Name: 4-nitro-5-(2-quinolylsulfanyl)phthalonitrile CAS Name: 4-nitro-5-(2-quinolinylthio)benzene-1,2-dicarbonitrile IUPAC Name: 4-nitro-5-quinolin-2-ylsulfanylbenzene-1,2-dicarbonitrile Traditional Name: 4-nitro-5-(2-quinolylthio)phthalonitrile Formula: C17H8N4O2S MolecularWeight: 332.33602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SC3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SC3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H8N4O2S/c18-9-12-7-15(21(22)23)16(8-13(12)10-19)24-17-6-5-11-3-1-2-4-14(11)20-17/h1-8H