2-methyl-2-phenyl-5-[2-(2-pyrazin-2-ylethylsulfanyl)-2-thiophen-3-yl-ethyl]furan-3-one

Systemtic Name: 2-methyl-2-phenyl-5-[2-(2-pyrazin-2-ylethylsulfanyl)-2-thiophen-3-yl-ethyl]furan-3-one Openeye Name: 2-methyl-2-phenyl-5-[2-(2-pyrazin-2-ylethylsulfanyl)-2-(3-thienyl)ethyl]furan-3-one CAS Name: 2-methyl-2-phenyl-5-[2-[2-(2-pyrazinyl)ethylthio]-2-(3-thiophenyl)ethyl]-3-furanone IUPAC Name: 2-methyl-2-phenyl-5-[2-(2-pyrazin-2-ylethylsulfanyl)-2-thiophen-3-ylethyl]furan-3-one Traditional Name: 2-methyl-2-phenyl-5-[2-(2-pyrazin-2-ylethylthio)-2-(3-thienyl)ethyl]furan-3-one Formula: C23H22N2O2S2 MolecularWeight: 422.56298

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C(O1)CC(C2=CSC=C2)SCCC3=NC=CN=C3)C4=CC=CC=C4

Isomeric SMILES

CC1(C(=O)C=C(O1)CC(C2=CSC=C2)SCCC3=NC=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O2S2/c1-23(18-5-3-2-4-6-18)22(26)14-20(27-23)13-21(17-7-11-28-16-17)29-12-8-19-15-24-9-10-25-19/h2-7,9-11,14-16,21H,8,12-13H2,1H3