6-[3-(1H-benzimidazol-2-yl)prop-2-ynyl]-3-(pyridin-4-ylmethyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine

Systemtic Name: 6-[3-(1H-benzimidazol-2-yl)prop-2-ynyl]-3-(pyridin-4-ylmethyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine Openeye Name: 6-[3-(1H-benzimidazol-2-yl)prop-2-ynyl]-3-(4-pyridylmethyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine CAS Name: 6-[3-(1H-benzimidazol-2-yl)prop-2-ynyl]-3-(pyridin-4-ylmethyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine IUPAC Name: 6-[3-(1H-benzimidazol-2-yl)prop-2-ynyl]-3-(pyridin-4-ylmethyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine Traditional Name: 6-[3-(1H-benzimidazol-2-yl)prop-2-ynyl]-3-(4-pyridylmethyl)-4,5,7,8-tetrahydropyrido[4,3-d]pyrimidine Formula: C23H22N6 MolecularWeight: 382.46098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1N=CN(C2)CC3=CC=NC=C3)CC#CC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CN(CC2=C1N=CN(C2)CC3=CC=NC=C3)CC#CC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C23H22N6/c1-2-5-22-21(4-1)26-23(27-22)6-3-12-28-13-9-20-19(15-28)16-29(17-25-20)14-18-7-10-24-11-8-18/h1-2,4-5,7-8,10-11,17H,9,12-16H2,(H,26,27)