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

Systemtic Name: 2-[(4-ethylphenyl)methylsulfanyl]-6-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(4-ethylphenyl)methylsulfanyl]-6-methyl-5-(tetralin-6-ylmethyl)-1H-pyrimidin-4-one CAS Name: 2-[(4-ethylphenyl)methylthio]-6-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-[(4-ethylphenyl)methylsulfanyl]-6-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(4-ethylbenzyl)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:

CCC1=CC=C(C=C1)CSC2=NC(=O)C(=C(N2)C)CC3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CCC1=CC=C(C=C1)CSC2=NC(=O)C(=C(N2)C)CC3=CC4=C(CCCC4)C=C3

InChI

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