3-[6-(4-azanylphenoxy)pyrimidin-4-yl]-1-[1-(2-dimethylaminoethyl)piperidin-4-yl]-1-methyl-urea

Systemtic Name: 3-[6-(4-azanylphenoxy)pyrimidin-4-yl]-1-[1-(2-dimethylaminoethyl)piperidin-4-yl]-1-methyl-urea Openeye Name: 3-[6-(4-aminophenoxy)pyrimidin-4-yl]-1-[1-(2-dimethylaminoethyl)-4-piperidyl]-1-methyl-urea CAS Name: 3-[6-(4-aminophenoxy)-4-pyrimidinyl]-1-[1-(2-dimethylaminoethyl)-4-piperidinyl]-1-methylurea IUPAC Name: 3-[6-(4-aminophenoxy)pyrimidin-4-yl]-1-[1-(2-dimethylaminoethyl)piperidin-4-yl]-1-methylurea Traditional Name: 3-[6-(4-aminophenoxy)pyrimidin-4-yl]-1-[1-(2-dimethylaminoethyl)-4-piperidyl]-1-methyl-urea Formula: C21H31N7O2 MolecularWeight: 413.51654

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1CCC(CC1)N(C)C(=O)NC2=CC(=NC=N2)OC3=CC=C(C=C3)N

Isomeric SMILES

CN(C)CCN1CCC(CC1)N(C)C(=O)NC2=CC(=NC=N2)OC3=CC=C(C=C3)N

InChI

InChI=1S/C21H31N7O2/c1-26(2)12-13-28-10-8-17(9-11-28)27(3)21(29)25-19-14-20(24-15-23-19)30-18-6-4-16(22)5-7-18/h4-7,14-15,17H,8-13,22H2,1-3H3,(H,23,24,25,29)