2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)ethanone

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)ethanone Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)ethanone IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 1-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-[ethyl(piperonyl)amino]ethanone Formula: C23H23N3O3S2 MolecularWeight: 453.57702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)N3C(CC(=N3)C4=CC=CS4)C5=CC=CS5

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)N3C(CC(=N3)C4=CC=CS4)C5=CC=CS5

InChI

InChI=1S/C23H23N3O3S2/c1-2-25(13-16-7-8-19-20(11-16)29-15-28-19)14-23(27)26-18(22-6-4-10-31-22)12-17(24-26)21-5-3-9-30-21/h3-11,18H,2,12-15H2,1H3