2-(2-methylpropylsulfanyl)-6-oxidanyl-5-(phenylmethyl)-1-prop-2-enyl-pyrimidin-4-one

Systemtic Name: 2-(2-methylpropylsulfanyl)-6-oxidanyl-5-(phenylmethyl)-1-prop-2-enyl-pyrimidin-4-one Openeye Name: 1-allyl-5-benzyl-6-hydroxy-2-isobutylsulfanyl-pyrimidin-4-one CAS Name: 6-hydroxy-2-(2-methylpropylthio)-5-(phenylmethyl)-1-prop-2-enyl-4-pyrimidinone IUPAC Name: 5-benzyl-6-hydroxy-2-(2-methylpropylsulfanyl)-1-prop-2-enylpyrimidin-4-one Traditional Name: 1-allyl-5-benzyl-6-hydroxy-2-(isobutylthio)pyrimidin-4-one Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC(=O)C(=C(N1CC=C)O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CSC1=NC(=O)C(=C(N1CC=C)O)CC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O2S/c1-4-10-20-17(22)15(11-14-8-6-5-7-9-14)16(21)19-18(20)23-12-13(2)3/h4-9,13,22H,1,10-12H2,2-3H3