N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylpiperazin-1-yl)-4-(1-phenylcyclopentyl)pyrimidine-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylpiperazin-1-yl)-4-(1-phenylcyclopentyl)pyrimidine-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylpiperazin-1-yl)-4-(1-phenylcyclopentyl)pyrimidine-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methyl-1-piperazinyl)-4-(1-phenylcyclopentyl)-5-pyrimidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylpiperazin-1-yl)-4-(1-phenylcyclopentyl)pyrimidine-5-carboxamide Traditional Name: 2-(4-methylpiperazino)-4-(1-phenylcyclopentyl)-N-piperonyl-pyrimidine-5-carboxamide Formula: C29H33N5O3 MolecularWeight: 499.60402

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C(=N2)C3(CCCC3)C4=CC=CC=C4)C(=O)NCC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C(=N2)C3(CCCC3)C4=CC=CC=C4)C(=O)NCC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H33N5O3/c1-33-13-15-34(16-14-33)28-31-19-23(27(35)30-18-21-9-10-24-25(17-21)37-20-36-24)26(32-28)29(11-5-6-12-29)22-7-3-2-4-8-22/h2-4,7-10,17,19H,5-6,11-16,18,20H2,1H3,(H,30,35)