N-(1-adamantylmethyl)-7-[(3-bromophenyl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(1-adamantylmethyl)-7-[(3-bromophenyl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine Openeye Name: N-(1-adamantylmethyl)-7-[(3-bromophenyl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine CAS Name: N-(1-adamantylmethyl)-7-[(3-bromophenyl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine IUPAC Name: N-(1-adamantylmethyl)-7-[(3-bromophenyl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine Traditional Name: 1-adamantylmethyl-[7-(3-bromobenzyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]amine Formula: C25H31BrN4 MolecularWeight: 467.44444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=NC=N2)NCC34CC5CC(C3)CC(C5)C4)CC6=CC(=CC=C6)Br

Isomeric SMILES

C1CN(CC2=C1C(=NC=N2)NCC34CC5CC(C3)CC(C5)C4)CC6=CC(=CC=C6)Br

InChI

InChI=1S/C25H31BrN4/c26-21-3-1-2-17(9-21)13-30-5-4-22-23(14-30)28-16-29-24(22)27-15-25-10-18-6-19(11-25)8-20(7-18)12-25/h1-3,9,16,18-20H,4-8,10-15H2,(H,27,28,29)