1-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-2-[(1-methyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(1-methylimidazol-2-yl)sulfanylethanone Traditional Name: 1-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-2-[(1-methylimidazol-2-yl)thio]ethanone Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CN1C=CN=C1SCC(=O)N2CCC[C@H]2C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H21N3O3S/c1-20-8-6-19-18(20)25-12-17(22)21-7-2-3-14(21)13-4-5-15-16(11-13)24-10-9-23-15/h4-6,8,11,14H,2-3,7,9-10,12H2,1H3/t14-/m0/s1