1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(6,7-dimethyl-1-benzofuran-3-yl)ethanone

Systemtic Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(6,7-dimethyl-1-benzofuran-3-yl)ethanone Openeye Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(6,7-dimethylbenzofuran-3-yl)ethanone CAS Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-2-(6,7-dimethyl-3-benzofuranyl)ethanone IUPAC Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(6,7-dimethyl-1-benzofuran-3-yl)ethanone Traditional Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-2-(6,7-dimethylbenzofuran-3-yl)ethanone Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N3CCCC3C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N3CCC[C@@H]3C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C23H22N2O2S/c1-14-9-10-17-16(13-27-22(17)15(14)2)12-21(26)25-11-5-7-19(25)23-24-18-6-3-4-8-20(18)28-23/h3-4,6,8-10,13,19H,5,7,11-12H2,1-2H3/t19-/m1/s1