N-(1,3-benzodioxol-5-yl)-4-(6-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-(6-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-[6-(1-piperidyl)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-(6-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-(6-piperidinopyrimidin-4-yl)piperazine-1-carboxamide Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H26N6O3/c28-21(24-16-4-5-17-18(12-16)30-15-29-17)27-10-8-26(9-11-27)20-13-19(22-14-23-20)25-6-2-1-3-7-25/h4-5,12-14H,1-3,6-11,15H2,(H,24,28)