4-(3,4-dichlorophenyl)-6-oxidanylidene-2-sulfanylidene-1,3-diazinane-5-carbonitrile

Systemtic Name: 4-(3,4-dichlorophenyl)-6-oxidanylidene-2-sulfanylidene-1,3-diazinane-5-carbonitrile Openeye Name: 4-(3,4-dichlorophenyl)-6-oxo-2-thioxo-hexahydropyrimidine-5-carbonitrile CAS Name: 4-(3,4-dichlorophenyl)-6-oxo-2-sulfanylidene-1,3-diazinane-5-carbonitrile IUPAC Name: 4-(3,4-dichlorophenyl)-6-oxo-2-sulfanylidene-1,3-diazinane-5-carbonitrile Traditional Name: 4-(3,4-dichlorophenyl)-6-keto-2-thioxo-hexahydropyrimidine-5-carbonitrile Formula: C11H7Cl2N3OS MolecularWeight: 300.16378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2C(C(=O)NC(=S)N2)C#N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C2C(C(=O)NC(=S)N2)C#N)Cl)Cl

InChI

InChI=1S/C11H7Cl2N3OS/c12-7-2-1-5(3-8(7)13)9-6(4-14)10(17)16-11(18)15-9/h1-3,6,9H,(H2,15,16,17,18)