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

Systemtic Name: (4Z)-2-butoxy-4-(2,4-dipyrrolidin-1-yl-1H-pyrimidin-6-ylidene)-3-piperazin-1-yl-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-2-butoxy-4-(2,4-dipyrrolidin-1-yl-1H-pyrimidin-6-ylidene)-3-piperazin-1-yl-cyclohexa-2,5-dien-1-one CAS Name: (4Z)-4-[2,4-bis(1-pyrrolidinyl)-1H-pyrimidin-6-ylidene]-2-butoxy-3-(1-piperazinyl)-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-2-butoxy-4-(2,4-dipyrrolidin-1-yl-1H-pyrimidin-6-ylidene)-3-piperazin-1-ylcyclohexa-2,5-dien-1-one Traditional Name: (4Z)-2-butoxy-4-(2,4-dipyrrolidino-1H-pyrimidin-6-ylidene)-3-piperazino-cyclohexa-2,5-dien-1-one Formula: C26H38N6O2 MolecularWeight: 466.61892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C2C=C(N=C(N2)N3CCCC3)N4CCCC4)C=CC1=O)N5CCNCC5

Isomeric SMILES

CCCCOC1=C(/C(=C\2/C=C(N=C(N2)N3CCCC3)N4CCCC4)/C=CC1=O)N5CCNCC5

InChI

InChI=1S/C26H38N6O2/c1-2-3-18-34-25-22(33)9-8-20(24(25)31-16-10-27-11-17-31)21-19-23(30-12-4-5-13-30)29-26(28-21)32-14-6-7-15-32/h8-9,19,27H,2-7,10-18H2,1H3,(H,28,29)/b21-20-