N-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-N'-methyl-N'-(phenylmethyl)propane-1,3-diamine

Systemtic Name: N-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-N'-methyl-N'-(phenylmethyl)propane-1,3-diamine Openeye Name: N'-benzyl-N-[3-(4-chlorophenyl)isoxazolo[5,4-d]pyrimidin-4-yl]-N'-methyl-propane-1,3-diamine CAS Name: N-[3-(4-chlorophenyl)-4-isoxazolo[5,4-d]pyrimidinyl]-N'-methyl-N'-(phenylmethyl)propane-1,3-diamine IUPAC Name: N'-benzyl-N-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-N'-methylpropane-1,3-diamine Traditional Name: benzyl-[3-[[3-(4-chlorophenyl)isoxazolo[5,4-d]pyrimidin-4-yl]amino]propyl]-methyl-amine Formula: C22H22ClN5O MolecularWeight: 407.89598

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC1=C2C(=NOC2=NC=N1)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CN(CCCNC1=C2C(=NOC2=NC=N1)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H22ClN5O/c1-28(14-16-6-3-2-4-7-16)13-5-12-24-21-19-20(17-8-10-18(23)11-9-17)27-29-22(19)26-15-25-21/h2-4,6-11,15H,5,12-14H2,1H3,(H,24,25,26)