[2-(2-azanylethyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-2-yl]-(1,3-benzodioxol-5-yl)methanone

Systemtic Name: [2-(2-azanylethyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-2-yl]-(1,3-benzodioxol-5-yl)methanone Openeye Name: [2-(2-aminoethyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-piperidyl]-(1,3-benzodioxol-5-yl)methanone CAS Name: [2-(2-aminoethyl)-1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-2-piperidinyl]-(1,3-benzodioxol-5-yl)methanone IUPAC Name: [2-(2-aminoethyl)-1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)piperidin-2-yl]-(1,3-benzodioxol-5-yl)methanone Traditional Name: [2-(2-aminoethyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-piperidyl]-(1,3-benzodioxol-5-yl)methanone Formula: C23H26N6O3 MolecularWeight: 434.49094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCCC3(CCN)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCCC3(CCN)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H26N6O3/c1-16-12-20(27-22(26-16)28-11-9-25-14-28)29-10-3-2-6-23(29,7-8-24)21(30)17-4-5-18-19(13-17)32-15-31-18/h4-5,9,11-14H,2-3,6-8,10,15,24H2,1H3