5-methyl-6-(phenylmethyl)-2-pyridin-3-ylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 5-methyl-6-(phenylmethyl)-2-pyridin-3-ylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-benzyl-5-methyl-2-(3-pyridylsulfanyl)-1H-pyrimidin-4-one CAS Name: 5-methyl-6-(phenylmethyl)-2-(3-pyridinylthio)-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-5-methyl-2-pyridin-3-ylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-benzyl-5-methyl-2-(3-pyridylthio)-1H-pyrimidin-4-one Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SC2=CN=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=NC1=O)SC2=CN=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H15N3OS/c1-12-15(10-13-6-3-2-4-7-13)19-17(20-16(12)21)22-14-8-5-9-18-11-14/h2-9,11H,10H2,1H3,(H,19,20,21)