3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-2-oxidanyl-pyridin-4-one

Systemtic Name: 3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-1-[(4-methoxyphenyl)methyl]-6-methyl-2-oxidanyl-pyridin-4-one Openeye Name: 3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-2-hydroxy-1-[(4-methoxyphenyl)methyl]-6-methyl-pyridin-4-one CAS Name: 3-[(4-ethyl-1-piperazinyl)-[4-(methylthio)phenyl]methyl]-2-hydroxy-1-[(4-methoxyphenyl)methyl]-6-methyl-4-pyridinone IUPAC Name: 3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-2-hydroxy-1-[(4-methoxyphenyl)methyl]-6-methylpyridin-4-one Traditional Name: 3-[(4-ethylpiperazino)-[4-(methylthio)phenyl]methyl]-2-hydroxy-6-methyl-1-p-anisyl-4-pyridone Formula: C28H35N3O3S MolecularWeight: 493.6608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(C2=CC=C(C=C2)SC)C3=C(N(C(=CC3=O)C)CC4=CC=C(C=C4)OC)O

Isomeric SMILES

CCN1CCN(CC1)C(C2=CC=C(C=C2)SC)C3=C(N(C(=CC3=O)C)CC4=CC=C(C=C4)OC)O

InChI

InChI=1S/C28H35N3O3S/c1-5-29-14-16-30(17-15-29)27(22-8-12-24(35-4)13-9-22)26-25(32)18-20(2)31(28(26)33)19-21-6-10-23(34-3)11-7-21/h6-13,18,27,33H,5,14-17,19H2,1-4H3