5-[(4-dimethylaminophenyl)methyl]-2-methoxy-3-(2-pyridin-2-ylsulfanylethyl)cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 5-[(4-dimethylaminophenyl)methyl]-2-methoxy-3-(2-pyridin-2-ylsulfanylethyl)cyclohexa-2,5-diene-1,4-dione Openeye Name: 5-[(4-dimethylaminophenyl)methyl]-2-methoxy-3-[2-(2-pyridylsulfanyl)ethyl]-1,4-benzoquinone CAS Name: 5-[(4-dimethylaminophenyl)methyl]-2-methoxy-3-[2-(2-pyridinylthio)ethyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 5-[(4-dimethylaminophenyl)methyl]-2-methoxy-3-(2-pyridin-2-ylsulfanylethyl)cyclohexa-2,5-diene-1,4-dione Traditional Name: 5-[4-(dimethylamino)benzyl]-2-methoxy-3-[2-(2-pyridylthio)ethyl]-p-benzoquinone Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CC2=CC(=O)C(=C(C2=O)CCSC3=CC=CC=N3)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CC2=CC(=O)C(=C(C2=O)CCSC3=CC=CC=N3)OC

InChI

InChI=1S/C23H24N2O3S/c1-25(2)18-9-7-16(8-10-18)14-17-15-20(26)23(28-3)19(22(17)27)11-13-29-21-6-4-5-12-24-21/h4-10,12,15H,11,13-14H2,1-3H3