1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[methyl(2-phenoxyethyl)amino]ethanone

Systemtic Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[methyl(2-phenoxyethyl)amino]ethanone Openeye Name: 1-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-[methyl(2-phenoxyethyl)amino]ethanone CAS Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[methyl(2-phenoxyethyl)amino]ethanone IUPAC Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[methyl(2-phenoxyethyl)amino]ethanone Traditional Name: 1-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-[methyl(2-phenoxyethyl)amino]ethanone Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=CC=C1)CC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CN(CCOC1=CC=CC=C1)CC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C22H23N3O2S2/c1-24(11-12-27-17-7-3-2-4-8-17)16-22(26)25-19(21-10-6-14-29-21)15-18(23-25)20-9-5-13-28-20/h2-10,13-14,19H,11-12,15-16H2,1H3