6,7-dimethoxy-N2-[1-(phenylmethyl)piperidin-4-yl]quinazoline-2,4-diamine

Systemtic Name: 6,7-dimethoxy-N2-[1-(phenylmethyl)piperidin-4-yl]quinazoline-2,4-diamine Openeye Name: N2-(1-benzyl-4-piperidyl)-6,7-dimethoxy-quinazoline-2,4-diamine CAS Name: 6,7-dimethoxy-N2-[1-(phenylmethyl)-4-piperidinyl]quinazoline-2,4-diamine IUPAC Name: 2-N-(1-benzylpiperidin-4-yl)-6,7-dimethoxyquinazoline-2,4-diamine Traditional Name: (4-amino-6,7-dimethoxy-quinazolin-2-yl)-(1-benzyl-4-piperidyl)amine Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)NC3CCN(CC3)CC4=CC=CC=C4)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)NC3CCN(CC3)CC4=CC=CC=C4)N)OC

InChI

InChI=1S/C22H27N5O2/c1-28-19-12-17-18(13-20(19)29-2)25-22(26-21(17)23)24-16-8-10-27(11-9-16)14-15-6-4-3-5-7-15/h3-7,12-13,16H,8-11,14H2,1-2H3,(H3,23,24,25,26)