1-(4-ethoxyphenyl)-3-[2-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]oxyethyl]urea

Systemtic Name: 1-(4-ethoxyphenyl)-3-[2-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]oxyethyl]urea Openeye Name: 1-(4-ethoxyphenyl)-3-[2-[6-(4-methyl-1-piperidyl)pyrimidin-4-yl]oxyethyl]urea CAS Name: 1-(4-ethoxyphenyl)-3-[2-[[6-(4-methyl-1-piperidinyl)-4-pyrimidinyl]oxy]ethyl]urea IUPAC Name: 1-(4-ethoxyphenyl)-3-[2-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]oxyethyl]urea Traditional Name: 1-[2-[6-(4-methylpiperidino)pyrimidin-4-yl]oxyethyl]-3-p-phenetyl-urea Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NCCOC2=NC=NC(=C2)N3CCC(CC3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NCCOC2=NC=NC(=C2)N3CCC(CC3)C

InChI

InChI=1S/C21H29N5O3/c1-3-28-18-6-4-17(5-7-18)25-21(27)22-10-13-29-20-14-19(23-15-24-20)26-11-8-16(2)9-12-26/h4-7,14-16H,3,8-13H2,1-2H3,(H2,22,25,27)