2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-1-[3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-1-[3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-1-[3-(2-furyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-[(5-bromo-2-thiophenyl)methyl-ethylamino]-1-[3-(2-furanyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-[(5-bromothiophen-2-yl)methyl-ethylamino]-1-[3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-1-[5-(2-furyl)-3-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C20H20BrN3O2S2 MolecularWeight: 478.4257

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)CC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CO4

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)CC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CO4

InChI

InChI=1S/C20H20BrN3O2S2/c1-2-23(12-14-7-8-19(21)28-14)13-20(25)24-16(17-5-3-9-26-17)11-15(22-24)18-6-4-10-27-18/h3-10,16H,2,11-13H2,1H3