6-(1-benzothiophen-3-ylmethyl)-5-methyl-2-propan-2-ylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-(1-benzothiophen-3-ylmethyl)-5-methyl-2-propan-2-ylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-(benzothiophen-3-ylmethyl)-2-isopropylsulfanyl-5-methyl-1H-pyrimidin-4-one CAS Name: 6-(1-benzothiophen-3-ylmethyl)-5-methyl-2-(propan-2-ylthio)-1H-pyrimidin-4-one IUPAC Name: 6-(1-benzothiophen-3-ylmethyl)-5-methyl-2-propan-2-ylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-(benzothiophen-3-ylmethyl)-2-(isopropylthio)-5-methyl-1H-pyrimidin-4-one Formula: C17H18N2OS2 MolecularWeight: 330.46762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SC(C)C)CC2=CSC3=CC=CC=C32

Isomeric SMILES

CC1=C(NC(=NC1=O)SC(C)C)CC2=CSC3=CC=CC=C32

InChI

InChI=1S/C17H18N2OS2/c1-10(2)22-17-18-14(11(3)16(20)19-17)8-12-9-21-15-7-5-4-6-13(12)15/h4-7,9-10H,8H2,1-3H3,(H,18,19,20)