6-(aminomethyl)-2-[4-[[2-(cyclohexen-1-yl)ethyl-ethyl-amino]methyl]phenyl]-1H-pyrimidin-4-one

Systemtic Name: 6-(aminomethyl)-2-[4-[[2-(cyclohexen-1-yl)ethyl-ethyl-amino]methyl]phenyl]-1H-pyrimidin-4-one Openeye Name: 6-(aminomethyl)-2-[4-[[2-(cyclohexen-1-yl)ethyl-ethyl-amino]methyl]phenyl]-1H-pyrimidin-4-one CAS Name: 6-(aminomethyl)-2-[4-[[2-(1-cyclohexenyl)ethyl-ethylamino]methyl]phenyl]-1H-pyrimidin-4-one IUPAC Name: 6-(aminomethyl)-2-[4-[[2-(cyclohexen-1-yl)ethyl-ethylamino]methyl]phenyl]-1H-pyrimidin-4-one Traditional Name: 6-(aminomethyl)-2-[4-[[2-(cyclohexen-1-yl)ethyl-ethyl-amino]methyl]phenyl]-1H-pyrimidin-4-one Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC1=CCCCC1)CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)CN

Isomeric SMILES

CCN(CCC1=CCCCC1)CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)CN

InChI

InChI=1S/C22H30N4O/c1-2-26(13-12-17-6-4-3-5-7-17)16-18-8-10-19(11-9-18)22-24-20(15-23)14-21(27)25-22/h6,8-11,14H,2-5,7,12-13,15-16,23H2,1H3,(H,24,25,27)