2-[(2,5-dimethylphenyl)methylsulfanyl]-6-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-6-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-6-methyl-5-(tetralin-6-ylmethyl)-1H-pyrimidin-4-one CAS Name: 2-[(2,5-dimethylphenyl)methylthio]-6-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-6-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(2,5-dimethylbenzyl)thio]-6-methyl-5-(tetralin-6-ylmethyl)-1H-pyrimidin-4-one Formula: C25H28N2OS MolecularWeight: 404.56762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC(=O)C(=C(N2)C)CC3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC(=O)C(=C(N2)C)CC3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C25H28N2OS/c1-16-8-9-17(2)22(12-16)15-29-25-26-18(3)23(24(28)27-25)14-19-10-11-20-6-4-5-7-21(20)13-19/h8-13H,4-7,14-15H2,1-3H3,(H,26,27,28)