1-[4-[2-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[2-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]phenyl]propan-1-one Openeye Name: 1-[4-[2-[(3R)-3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethoxy]phenyl]propan-1-one CAS Name: 1-[4-[2-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[2-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]phenyl]propan-1-one Traditional Name: 1-[4-[2-[(5R)-3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethoxy]phenyl]propan-1-one Formula: C22H20N2O3S2 MolecularWeight: 424.5358

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)N2[C@H](CC(=N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C22H20N2O3S2/c1-2-19(25)15-7-9-16(10-8-15)27-14-22(26)24-18(21-6-4-12-29-21)13-17(23-24)20-5-3-11-28-20/h3-12,18H,2,13-14H2,1H3/t18-/m1/s1