2-[3-(2-methoxy-4-prop-1-enyl-phenoxy)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[3-(2-methoxy-4-prop-1-enyl-phenoxy)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[3-(2-methoxy-4-prop-1-enyl-phenoxy)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[3-(2-methoxy-4-prop-1-enylphenoxy)propylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[3-(2-methoxy-4-prop-1-enylphenoxy)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[3-(2-methoxy-4-prop-1-enyl-phenoxy)propylthio]-6-methyl-1H-pyrimidin-4-one Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C=C1)OCCCSC2=NC(=O)C=C(N2)C)OC

Isomeric SMILES

CC=CC1=CC(=C(C=C1)OCCCSC2=NC(=O)C=C(N2)C)OC

InChI

InChI=1S/C18H22N2O3S/c1-4-6-14-7-8-15(16(12-14)22-3)23-9-5-10-24-18-19-13(2)11-17(21)20-18/h4,6-8,11-12H,5,9-10H2,1-3H3,(H,19,20,21)