(6Z)-1-cyclopentyl-3-ethyl-6-(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: (6Z)-1-cyclopentyl-3-ethyl-6-(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: (6Z)-6-(5-allyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1-cyclopentyl-3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: (6Z)-1-cyclopentyl-3-ethyl-6-(6-oxo-5-prop-2-enyl-1-cyclohexa-2,4-dienylidene)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: (6Z)-1-cyclopentyl-3-ethyl-6-(6-oxo-5-prop-2-enylcyclohexa-2,4-dien-1-ylidene)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: (6Z)-6-(5-allyl-6-keto-cyclohexa-2,4-dien-1-ylidene)-1-cyclopentyl-3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=O)NC(=C3C=CC=C(C3=O)CC=C)N=C2N(N1)C4CCCC4

Isomeric SMILES

CCC1=C2C(=O)N/C(=C/3\C=CC=C(C3=O)CC=C)/N=C2N(N1)C4CCCC4

InChI

InChI=1S/C21H24N4O2/c1-3-8-13-9-7-12-15(18(13)26)19-22-20-17(21(27)23-19)16(4-2)24-25(20)14-10-5-6-11-14/h3,7,9,12,14,24H,1,4-6,8,10-11H2,2H3,(H,23,27)/b19-15+