methyl 6-[[4-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]amino]hexanoate

Systemtic Name: methyl 6-[[4-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]amino]hexanoate Openeye Name: methyl 6-[[4-(1-methylsulfonylindolin-5-yl)thiazol-2-yl]amino]hexanoate CAS Name: 6-[[4-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-2-thiazolyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[4-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]amino]hexanoate Traditional Name: 6-[[4-(1-mesylindolin-5-yl)thiazol-2-yl]amino]hexanoic acid methyl ester Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC1=NC(=CS1)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C

Isomeric SMILES

COC(=O)CCCCCNC1=NC(=CS1)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C

InChI

InChI=1S/C19H25N3O4S2/c1-26-18(23)6-4-3-5-10-20-19-21-16(13-27-19)14-7-8-17-15(12-14)9-11-22(17)28(2,24)25/h7-8,12-13H,3-6,9-11H2,1-2H3,(H,20,21)