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

Systemtic Name: 1-(5-chloranyl-2,4-dimethoxy-phenyl)-3-[2-[(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)amino]ethyl]urea Openeye Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-[2-[[4-methyl-6-(1-piperidyl)pyrimidin-2-yl]amino]ethyl]urea CAS Name: 1-(5-chloro-2,4-dimethoxyphenyl)-3-[2-[[4-methyl-6-(1-piperidinyl)-2-pyrimidinyl]amino]ethyl]urea IUPAC Name: 1-(5-chloro-2,4-dimethoxyphenyl)-3-[2-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)amino]ethyl]urea Traditional Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-[2-[(4-methyl-6-piperidino-pyrimidin-2-yl)amino]ethyl]urea Formula: C21H29ClN6O3 MolecularWeight: 448.94636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NCCNC(=O)NC2=CC(=C(C=C2OC)OC)Cl)N3CCCCC3

Isomeric SMILES

CC1=CC(=NC(=N1)NCCNC(=O)NC2=CC(=C(C=C2OC)OC)Cl)N3CCCCC3

InChI

InChI=1S/C21H29ClN6O3/c1-14-11-19(28-9-5-4-6-10-28)27-20(25-14)23-7-8-24-21(29)26-16-12-15(22)17(30-2)13-18(16)31-3/h11-13H,4-10H2,1-3H3,(H,23,25,27)(H2,24,26,29)