(2Z)-4-azanyl-2-[3,5-bis(chloranyl)-2-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-6-piperidin-3-yl-1H-pyrimidine-5-carbonitrile

Systemtic Name: (2Z)-4-azanyl-2-[3,5-bis(chloranyl)-2-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-6-piperidin-3-yl-1H-pyrimidine-5-carbonitrile Openeye Name: (2Z)-4-amino-2-(3,5-dichloro-2-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-6-(3-piperidyl)-1H-pyrimidine-5-carbonitrile CAS Name: (2Z)-4-amino-2-(3,5-dichloro-2-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)-6-(3-piperidinyl)-1H-pyrimidine-5-carbonitrile IUPAC Name: (2Z)-4-amino-2-(3,5-dichloro-2-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-6-piperidin-3-yl-1H-pyrimidine-5-carbonitrile Traditional Name: (2Z)-4-amino-2-(3,5-dichloro-2-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene)-6-(3-piperidyl)-1H-pyrimidine-5-carbonitrile Formula: C16H15Cl2N5O2 MolecularWeight: 380.2286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C2=C(C(=NC(=C3C(=C(C=C(C3=O)Cl)Cl)O)N2)N)C#N

Isomeric SMILES

C1CC(CNC1)C2=C(C(=N/C(=C\3/C(=C(C=C(C3=O)Cl)Cl)O)/N2)N)C#N

InChI

InChI=1S/C16H15Cl2N5O2/c17-9-4-10(18)14(25)11(13(9)24)16-22-12(7-2-1-3-21-6-7)8(5-19)15(20)23-16/h4,7,21-22,24H,1-3,6H2,(H2,20,23)/b16-11-