(6E)-6-(2-azanyl-6-piperidin-4-yl-1H-pyrimidin-4-ylidene)-4-methyl-cyclohexa-2,4-dien-1-one dihydrochloride

Systemtic Name: (6E)-6-(2-azanyl-6-piperidin-4-yl-1H-pyrimidin-4-ylidene)-4-methyl-cyclohexa-2,4-dien-1-one dihydrochloride Openeye Name: (6E)-6-[2-amino-6-(4-piperidyl)-1H-pyrimidin-4-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one dihydrochloride CAS Name: (6E)-6-[2-amino-6-(4-piperidinyl)-1H-pyrimidin-4-ylidene]-4-methyl-1-cyclohexa-2,4-dienone dihydrochloride IUPAC Name: (6E)-6-(2-amino-6-piperidin-4-yl-1H-pyrimidin-4-ylidene)-4-methylcyclohexa-2,4-dien-1-one dihydrochloride Traditional Name: (6E)-6-[2-amino-6-(4-piperidyl)-1H-pyrimidin-4-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one dihydrochloride Formula: C16H22Cl2N4O MolecularWeight: 357.27808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC(=N2)N)C3CCNCC3)C(=O)C=C1.Cl.Cl

Isomeric SMILES

CC1=C/C(=C\2/C=C(NC(=N2)N)C3CCNCC3)/C(=O)C=C1.Cl.Cl

InChI

InChI=1S/C16H20N4O.2ClH/c1-10-2-3-15(21)12(8-10)14-9-13(19-16(17)20-14)11-4-6-18-7-5-11;;/h2-3,8-9,11,18H,4-7H2,1H3,(H3,17,19,20);2*1H/b14-12+;;