1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanone Openeye Name: 1-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanone CAS Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]ethanone Formula: C20H20N4OS3 MolecularWeight: 428.594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4)C

InChI

InChI=1S/C20H20N4OS3/c1-12-13(2)21-20(22-14(12)3)28-11-19(25)24-16(18-7-5-9-27-18)10-15(23-24)17-6-4-8-26-17/h4-9,16H,10-11H2,1-3H3