3-(phenylmethyl)-6-(3-pyridin-4-ylprop-2-ynyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine

Systemtic Name: 3-(phenylmethyl)-6-(3-pyridin-4-ylprop-2-ynyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine Openeye Name: 3-benzyl-6-[3-(4-pyridyl)prop-2-ynyl]-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine CAS Name: 3-(phenylmethyl)-6-(3-pyridin-4-ylprop-2-ynyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine IUPAC Name: 3-benzyl-6-(3-pyridin-4-ylprop-2-ynyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine Traditional Name: 3-benzyl-6-[3-(4-pyridyl)prop-2-ynyl]-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine Formula: C22H22N4 MolecularWeight: 342.43688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1N=CN(C2)CC3=CC=CC=C3)CC#CC4=CC=NC=C4

Isomeric SMILES

C1CN(CC2=C1N=CN(C2)CC3=CC=CC=C3)CC#CC4=CC=NC=C4

InChI

InChI=1S/C22H22N4/c1-2-5-20(6-3-1)15-26-17-21-16-25(14-10-22(21)24-18-26)13-4-7-19-8-11-23-12-9-19/h1-3,5-6,8-9,11-12,18H,10,13-17H2