(4Z)-4-(2,4-dipyrrolidin-1-yl-1H-pyrimidin-6-ylidene)-5-ethyl-2-methyl-3,6-di(piperazin-1-yl)cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-4-(2,4-dipyrrolidin-1-yl-1H-pyrimidin-6-ylidene)-5-ethyl-2-methyl-3,6-di(piperazin-1-yl)cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-4-(2,4-dipyrrolidin-1-yl-1H-pyrimidin-6-ylidene)-5-ethyl-2-methyl-3,6-di(piperazin-1-yl)cyclohexa-2,5-dien-1-one CAS Name: (4Z)-4-[2,4-bis(1-pyrrolidinyl)-1H-pyrimidin-6-ylidene]-5-ethyl-2-methyl-3,6-bis(1-piperazinyl)-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-4-(2,4-dipyrrolidin-1-yl-1H-pyrimidin-6-ylidene)-5-ethyl-2-methyl-3,6-di(piperazin-1-yl)cyclohexa-2,5-dien-1-one Traditional Name: (4Z)-4-(2,4-dipyrrolidino-1H-pyrimidin-6-ylidene)-5-ethyl-2-methyl-3,6-di(piperazino)cyclohexa-2,5-dien-1-one Formula: C29H44N8O MolecularWeight: 520.71266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C(=C(C1=C2C=C(N=C(N2)N3CCCC3)N4CCCC4)N5CCNCC5)C)N6CCNCC6

Isomeric SMILES

CCC\1=C(C(=O)C(=C(/C1=C\2/C=C(N=C(N2)N3CCCC3)N4CCCC4)N5CCNCC5)C)N6CCNCC6

InChI

InChI=1S/C29H44N8O/c1-3-22-25(23-20-24(34-12-4-5-13-34)33-29(32-23)37-14-6-7-15-37)26(35-16-8-30-9-17-35)21(2)28(38)27(22)36-18-10-31-11-19-36/h20,30-31H,3-19H2,1-2H3,(H,32,33)/b25-23-