1-(1,3-benzodioxol-5-yl)-3-[2-[(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)amino]ethyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)amino]ethyl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[[4-methyl-6-(1-piperidyl)pyrimidin-2-yl]amino]ethyl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[[4-methyl-6-(1-piperidinyl)-2-pyrimidinyl]amino]ethyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)amino]ethyl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[(4-methyl-6-piperidino-pyrimidin-2-yl)amino]ethyl]urea Formula: C20H26N6O3 MolecularWeight: 398.45884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NCCNC(=O)NC2=CC3=C(C=C2)OCO3)N4CCCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)NCCNC(=O)NC2=CC3=C(C=C2)OCO3)N4CCCCC4

InChI

InChI=1S/C20H26N6O3/c1-14-11-18(26-9-3-2-4-10-26)25-19(23-14)21-7-8-22-20(27)24-15-5-6-16-17(12-15)29-13-28-16/h5-6,11-12H,2-4,7-10,13H2,1H3,(H,21,23,25)(H2,22,24,27)