6,7-dimethoxy-5-[[4-phenyl-1-(phenylmethyl)piperidin-4-yl]methyl]quinazoline-2,4-diamine

Systemtic Name: 6,7-dimethoxy-5-[[4-phenyl-1-(phenylmethyl)piperidin-4-yl]methyl]quinazoline-2,4-diamine Openeye Name: 5-[(1-benzyl-4-phenyl-4-piperidyl)methyl]-6,7-dimethoxy-quinazoline-2,4-diamine CAS Name: 6,7-dimethoxy-5-[[4-phenyl-1-(phenylmethyl)-4-piperidinyl]methyl]quinazoline-2,4-diamine IUPAC Name: 5-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]-6,7-dimethoxyquinazoline-2,4-diamine Traditional Name: [2-amino-5-[(1-benzyl-4-phenyl-4-piperidyl)methyl]-6,7-dimethoxy-quinazolin-4-yl]amine Formula: C29H33N5O2 MolecularWeight: 483.60462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)N=C(N=C2N)N)CC3(CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)N=C(N=C2N)N)CC3(CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C29H33N5O2/c1-35-24-17-23-25(27(30)33-28(31)32-23)22(26(24)36-2)18-29(21-11-7-4-8-12-21)13-15-34(16-14-29)19-20-9-5-3-6-10-20/h3-12,17H,13-16,18-19H2,1-2H3,(H4,30,31,32,33)