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

Systemtic Name: 1-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]-3-butyl-urea Openeye Name: 1-butyl-3-[4-[2,4-diamino-6-(benzyloxymethyl)pyrimidin-5-yl]phenyl]urea CAS Name: 1-butyl-3-[4-[2,4-diamino-6-(phenylmethoxymethyl)-5-pyrimidinyl]phenyl]urea IUPAC Name: 1-butyl-3-[4-[2,4-diamino-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]urea Traditional Name: 1-butyl-3-[4-[2,4-diamino-6-(benzoxymethyl)pyrimidin-5-yl]phenyl]urea Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N6O2/c1-2-3-13-26-23(30)27-18-11-9-17(10-12-18)20-19(28-22(25)29-21(20)24)15-31-14-16-7-5-4-6-8-16/h4-12H,2-3,13-15H2,1H3,(H2,26,27,30)(H4,24,25,28,29)