1-[5-[2,2-bis(methylsulfanyl)ethenyl]-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[5-[2,2-bis(methylsulfanyl)ethenyl]-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[5-[2,2-bis(methylsulfanyl)vinyl]-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[5-[2,2-bis(methylthio)ethenyl]-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[5-[2,2-bis(methylsulfanyl)ethenyl]-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[3-[2,2-bis(methylthio)vinyl]-5-(4-methoxyphenyl)-2-pyrazolin-1-yl]ethanone Formula: C16H20N2O2S2 MolecularWeight: 336.4722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C=C(SC)SC)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)N1C(CC(=N1)C=C(SC)SC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H20N2O2S2/c1-11(19)18-15(12-5-7-14(20-2)8-6-12)9-13(17-18)10-16(21-3)22-4/h5-8,10,15H,9H2,1-4H3