[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-pyrrol-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-pyrrol-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-pyrrol-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-3-pyrrolyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-pyrrol-3-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCCO3)C)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCCO3)C)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C23H25N5O3/c1-16-14-19(17(2)28(16)18-4-5-20-21(15-18)31-13-12-30-20)22(29)26-8-10-27(11-9-26)23-24-6-3-7-25-23/h3-7,14-15H,8-13H2,1-2H3