5-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]oxymethyl]quinazoline-2,4-diamine

Systemtic Name: 5-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]oxymethyl]quinazoline-2,4-diamine Openeye Name: 5-[[1-(m-tolylmethyl)-4-piperidyl]oxymethyl]quinazoline-2,4-diamine CAS Name: 5-[[1-[(3-methylphenyl)methyl]-4-piperidinyl]oxymethyl]quinazoline-2,4-diamine IUPAC Name: 5-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]oxymethyl]quinazoline-2,4-diamine Traditional Name: [2-amino-5-[[1-(3-methylbenzyl)-4-piperidyl]oxymethyl]quinazolin-4-yl]amine Formula: C22H27N5O MolecularWeight: 377.48268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC(CC2)OCC3=C4C(=CC=C3)N=C(N=C4N)N

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC(CC2)OCC3=C4C(=CC=C3)N=C(N=C4N)N

InChI

InChI=1S/C22H27N5O/c1-15-4-2-5-16(12-15)13-27-10-8-18(9-11-27)28-14-17-6-3-7-19-20(17)21(23)26-22(24)25-19/h2-7,12,18H,8-11,13-14H2,1H3,(H4,23,24,25,26)