2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2-methoxy-phenoxy]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2-methoxy-phenoxy]-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-methoxy-phenoxy]-1-morpholino-ethanone CAS Name: 2-[4-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-2-methoxyphenoxy]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-methoxyphenoxy]-1-morpholin-4-ylethanone Traditional Name: 2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-methoxy-phenoxy]-1-morpholino-ethanone Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3)OCC(=O)N5CCOCC5

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)N2CCC[C@H]2C3=NC4=CC=CC=C4S3)OCC(=O)N5CCOCC5

InChI

InChI=1S/C25H27N3O5S/c1-31-21-15-17(8-9-20(21)33-16-23(29)27-11-13-32-14-12-27)25(30)28-10-4-6-19(28)24-26-18-5-2-3-7-22(18)34-24/h2-3,5,7-9,15,19H,4,6,10-14,16H2,1H3/t19-/m0/s1