2-cyclopentylsulfanyl-4-oxidanyl-5-[(4-prop-2-enoxyphenyl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-cyclopentylsulfanyl-4-oxidanyl-5-[(4-prop-2-enoxyphenyl)methyl]-1H-pyrimidin-6-one Openeye Name: 5-[(4-allyloxyphenyl)methyl]-2-cyclopentylsulfanyl-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-(cyclopentylthio)-4-hydroxy-5-[(4-prop-2-enoxyphenyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-cyclopentylsulfanyl-4-hydroxy-5-[(4-prop-2-enoxyphenyl)methyl]-1H-pyrimidin-6-one Traditional Name: 5-(4-allyloxybenzyl)-2-(cyclopentylthio)-4-hydroxy-1H-pyrimidin-6-one Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SC3CCCC3)O

Isomeric SMILES

C=CCOC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SC3CCCC3)O

InChI

InChI=1S/C19H22N2O3S/c1-2-11-24-14-9-7-13(8-10-14)12-16-17(22)20-19(21-18(16)23)25-15-5-3-4-6-15/h2,7-10,15H,1,3-6,11-12H2,(H2,20,21,22,23)