2-(5-azanylpentylamino)-3-ethyl-6-pyridin-4-yl-pyrimidin-4-one; bicyclo[3.1.0]hexa-1(6),2,4-triene

Systemtic Name: 2-(5-azanylpentylamino)-3-ethyl-6-pyridin-4-yl-pyrimidin-4-one; bicyclo[3.1.0]hexa-1(6),2,4-triene Openeye Name: 2-(5-aminopentylamino)-3-ethyl-6-(4-pyridyl)pyrimidin-4-one; bicyclo[3.1.0]hexa-1(6),2,4-triene CAS Name: 2-(5-aminopentylamino)-3-ethyl-6-pyridin-4-yl-4-pyrimidinone; bicyclo[3.1.0]hexa-1(6),2,4-triene IUPAC Name: 2-(5-aminopentylamino)-3-ethyl-6-pyridin-4-ylpyrimidin-4-one; bicyclo[3.1.0]hexa-1(6),2,4-triene Traditional Name: 2-(5-aminopentylamino)-3-ethyl-6-(4-pyridyl)pyrimidin-4-one; bicyclo[3.1.0]hexa-1(6),2,4-triene Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=C(N=C1NCCCCCN)C2=CC=NC=C2.C1=CC2=CC2=C1

Isomeric SMILES

CCN1C(=O)C=C(N=C1NCCCCCN)C2=CC=NC=C2.C1=CC2=CC2=C1

InChI

InChI=1S/C16H23N5O.C6H4/c1-2-21-15(22)12-14(13-6-10-18-11-7-13)20-16(21)19-9-5-3-4-8-17;1-2-5-4-6(5)3-1/h6-7,10-12H,2-5,8-9,17H2,1H3,(H,19,20);1-4H