2-[2-(4-ethylphenoxy)ethylsulfanyl]-4-oxidanyl-5-propan-2-yl-1H-pyrimidin-6-one

Systemtic Name: 2-[2-(4-ethylphenoxy)ethylsulfanyl]-4-oxidanyl-5-propan-2-yl-1H-pyrimidin-6-one Openeye Name: 2-[2-(4-ethylphenoxy)ethylsulfanyl]-4-hydroxy-5-isopropyl-1H-pyrimidin-6-one CAS Name: 2-[2-(4-ethylphenoxy)ethylthio]-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one IUPAC Name: 2-[2-(4-ethylphenoxy)ethylsulfanyl]-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one Traditional Name: 2-[2-(4-ethylphenoxy)ethylthio]-4-hydroxy-5-isopropyl-1H-pyrimidin-6-one Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCSC2=NC(=C(C(=O)N2)C(C)C)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCCSC2=NC(=C(C(=O)N2)C(C)C)O

InChI

InChI=1S/C17H22N2O3S/c1-4-12-5-7-13(8-6-12)22-9-10-23-17-18-15(20)14(11(2)3)16(21)19-17/h5-8,11H,4,9-10H2,1-3H3,(H2,18,19,20,21)