2-butan-2-ylsulfanyl-5-(dimethylaminomethyl)-6-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-butan-2-ylsulfanyl-5-(dimethylaminomethyl)-6-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 6-benzyl-5-(dimethylaminomethyl)-2-sec-butylsulfanyl-1H-pyrimidin-4-one CAS Name: 2-(butan-2-ylthio)-5-(dimethylaminomethyl)-6-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-2-butan-2-ylsulfanyl-5-(dimethylaminomethyl)-1H-pyrimidin-4-one Traditional Name: 6-benzyl-5-(dimethylaminomethyl)-2-(sec-butylthio)-1H-pyrimidin-4-one Formula: C18H25N3OS MolecularWeight: 331.4756

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NC(=O)C(=C(N1)CC2=CC=CC=C2)CN(C)C

Isomeric SMILES

CCC(C)SC1=NC(=O)C(=C(N1)CC2=CC=CC=C2)CN(C)C

InChI

InChI=1S/C18H25N3OS/c1-5-13(2)23-18-19-16(11-14-9-7-6-8-10-14)15(12-21(3)4)17(22)20-18/h6-10,13H,5,11-12H2,1-4H3,(H,19,20,22)