1-[(2-methylphenyl)methyl]-4-phenyl-5-(piperidin-4-ylmethyl)quinazoline-2,4-diamine

Systemtic Name: 1-[(2-methylphenyl)methyl]-4-phenyl-5-(piperidin-4-ylmethyl)quinazoline-2,4-diamine Openeye Name: 1-(o-tolylmethyl)-4-phenyl-5-(4-piperidylmethyl)quinazoline-2,4-diamine CAS Name: 1-[(2-methylphenyl)methyl]-4-phenyl-5-(4-piperidinylmethyl)quinazoline-2,4-diamine IUPAC Name: 1-[(2-methylphenyl)methyl]-4-phenyl-5-(piperidin-4-ylmethyl)quinazoline-2,4-diamine Traditional Name: [2-amino-1-(2-methylbenzyl)-4-phenyl-5-(4-piperidylmethyl)quinazolin-4-yl]amine Formula: C28H33N5 MolecularWeight: 439.59512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C3=CC=CC(=C3C(N=C2N)(C4=CC=CC=C4)N)CC5CCNCC5

Isomeric SMILES

CC1=CC=CC=C1CN2C3=CC=CC(=C3C(N=C2N)(C4=CC=CC=C4)N)CC5CCNCC5

InChI

InChI=1S/C28H33N5/c1-20-8-5-6-9-23(20)19-33-25-13-7-10-22(18-21-14-16-31-17-15-21)26(25)28(30,32-27(33)29)24-11-3-2-4-12-24/h2-13,21,31H,14-19,30H2,1H3,(H2,29,32)