4-[6-(2-azanylethyl)-2-methyl-pyrimidin-4-yl]-1-(1,3-benzodioxol-5-ylmethyl)piperazin-2-one

Systemtic Name: 4-[6-(2-azanylethyl)-2-methyl-pyrimidin-4-yl]-1-(1,3-benzodioxol-5-ylmethyl)piperazin-2-one Openeye Name: 4-[6-(2-aminoethyl)-2-methyl-pyrimidin-4-yl]-1-(1,3-benzodioxol-5-ylmethyl)piperazin-2-one CAS Name: 4-[6-(2-aminoethyl)-2-methyl-4-pyrimidinyl]-1-(1,3-benzodioxol-5-ylmethyl)-2-piperazinone IUPAC Name: 4-[6-(2-aminoethyl)-2-methylpyrimidin-4-yl]-1-(1,3-benzodioxol-5-ylmethyl)piperazin-2-one Traditional Name: 4-[6-(2-aminoethyl)-2-methyl-pyrimidin-4-yl]-1-piperonyl-piperazin-2-one Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(C(=O)C2)CC3=CC4=C(C=C3)OCO4)CCN

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(C(=O)C2)CC3=CC4=C(C=C3)OCO4)CCN

InChI

InChI=1S/C19H23N5O3/c1-13-21-15(4-5-20)9-18(22-13)23-6-7-24(19(25)11-23)10-14-2-3-16-17(8-14)27-12-26-16/h2-3,8-9H,4-7,10-12,20H2,1H3