(6E)-6-(2-azanyl-6-piperidin-3-yl-1H-pyrimidin-4-ylidene)-5-(cyclopentylmethoxy)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(2-azanyl-6-piperidin-3-yl-1H-pyrimidin-4-ylidene)-5-(cyclopentylmethoxy)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[2-amino-6-(3-piperidyl)-1H-pyrimidin-4-ylidene]-5-(cyclopentylmethoxy)cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[2-amino-6-(3-piperidinyl)-1H-pyrimidin-4-ylidene]-5-(cyclopentylmethoxy)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(2-amino-6-piperidin-3-yl-1H-pyrimidin-4-ylidene)-5-(cyclopentylmethoxy)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[2-amino-6-(3-piperidyl)-1H-pyrimidin-4-ylidene]-5-(cyclopentylmethoxy)cyclohexa-2,4-dien-1-one Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)COC2=CC=CC(=O)C2=C3C=C(NC(=N3)N)C4CCCNC4

Isomeric SMILES

C1CCC(C1)COC\2=CC=CC(=O)/C2=C/3\C=C(NC(=N3)N)C4CCCNC4

InChI

InChI=1S/C21H28N4O2/c22-21-24-16(15-7-4-10-23-12-15)11-17(25-21)20-18(26)8-3-9-19(20)27-13-14-5-1-2-6-14/h3,8-9,11,14-15,23H,1-2,4-7,10,12-13H2,(H3,22,24,25)/b20-17-