1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]ethyl]urea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]ethyl]urea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]ethyl]urea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-[[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino]ethyl]urea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-[(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl]urea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-[(2-methyl-6-pyrrolidino-pyrimidin-4-yl)amino]ethyl]urea Formula: C20H26N6O3 MolecularWeight: 398.45884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NCCNC(=O)NC2=CC3=C(C=C2)OCCO3)N4CCCC4

Isomeric SMILES

CC1=NC(=CC(=N1)NCCNC(=O)NC2=CC3=C(C=C2)OCCO3)N4CCCC4

InChI

InChI=1S/C20H26N6O3/c1-14-23-18(13-19(24-14)26-8-2-3-9-26)21-6-7-22-20(27)25-15-4-5-16-17(12-15)29-11-10-28-16/h4-5,12-13H,2-3,6-11H2,1H3,(H,21,23,24)(H2,22,25,27)