5-(pyridin-3-ylmethyl)-2-[2-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylamino]-1H-pyrimidin-6-one

Systemtic Name: 5-(pyridin-3-ylmethyl)-2-[2-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylamino]-1H-pyrimidin-6-one Openeye Name: 5-(3-pyridylmethyl)-2-[2-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylamino]-1H-pyrimidin-6-one CAS Name: 5-(3-pyridinylmethyl)-2-[2-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylamino]-1H-pyrimidin-6-one IUPAC Name: 5-(pyridin-3-ylmethyl)-2-[2-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylamino]-1H-pyrimidin-6-one Traditional Name: 5-(3-pyridylmethyl)-2-[2-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylamino]-1H-pyrimidin-6-one Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CN=C2CCNC3=NC=C(C(=O)N3)CC4=CN=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C=CN=C2CCNC3=NC=C(C(=O)N3)CC4=CN=CC=C4

InChI

InChI=1S/C21H23N5O/c27-20-17(12-15-4-3-9-22-13-15)14-25-21(26-20)24-11-8-19-18-6-2-1-5-16(18)7-10-23-19/h3-4,7,9-10,13-14H,1-2,5-6,8,11-12H2,(H2,24,25,26,27)