3-[3-oxidanylidene-4-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)-5-(2-sulfanylideneethyl)-1,2-diazinan-1-yl]benzenecarbonitrile

Systemtic Name: 3-[3-oxidanylidene-4-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)-5-(2-sulfanylideneethyl)-1,2-diazinan-1-yl]benzenecarbonitrile Openeye Name: 3-[3-oxo-4-(6-thioxocyclohexa-1,3-dien-1-yl)-5-(2-thioxoethyl)hexahydropyridazin-1-yl]benzonitrile CAS Name: 3-[3-oxo-4-(6-sulfanylidene-1-cyclohexa-1,3-dienyl)-5-(2-sulfanylideneethyl)-1-diazinanyl]benzonitrile IUPAC Name: 3-[3-oxo-4-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)-5-(2-sulfanylideneethyl)diazinan-1-yl]benzonitrile Traditional Name: 3-[3-keto-4-(6-thioxocyclohexa-1,3-dien-1-yl)-5-(2-thioxoethyl)hexahydropyridazin-1-yl]benzonitrile Formula: C19H17N3OS2 MolecularWeight: 367.48778

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C(C1=S)C2C(CN(NC2=O)C3=CC=CC(=C3)C#N)CC=S

Isomeric SMILES

C1C=CC=C(C1=S)C2C(CN(NC2=O)C3=CC=CC(=C3)C#N)CC=S

InChI

InChI=1S/C19H17N3OS2/c20-11-13-4-3-5-15(10-13)22-12-14(8-9-24)18(19(23)21-22)16-6-1-2-7-17(16)25/h1-6,9-10,14,18H,7-8,12H2,(H,21,23)