1-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]-3-propan-2-yl-urea

Systemtic Name: 1-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]-3-propan-2-yl-urea Openeye Name: 1-[4-[2,4-diamino-6-(benzyloxymethyl)pyrimidin-5-yl]phenyl]-3-isopropyl-urea CAS Name: 1-[4-[2,4-diamino-6-(phenylmethoxymethyl)-5-pyrimidinyl]phenyl]-3-propan-2-ylurea IUPAC Name: 1-[4-[2,4-diamino-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]-3-propan-2-ylurea Traditional Name: 1-[4-[2,4-diamino-6-(benzoxymethyl)pyrimidin-5-yl]phenyl]-3-isopropyl-urea Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)C2=C(N=C(N=C2N)N)COCC3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)C2=C(N=C(N=C2N)N)COCC3=CC=CC=C3

InChI

InChI=1S/C22H26N6O2/c1-14(2)25-22(29)26-17-10-8-16(9-11-17)19-18(27-21(24)28-20(19)23)13-30-12-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H2,25,26,29)(H4,23,24,27,28)