2-(4-oxidanylcyclohexyl)-7-(3-oxidanylidene-6-pyrrolidin-3-yl-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one

Systemtic Name: 2-(4-oxidanylcyclohexyl)-7-(3-oxidanylidene-6-pyrrolidin-3-yl-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one Openeye Name: 2-(4-hydroxycyclohexyl)-7-(3-oxo-6-pyrrolidin-3-yl-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one CAS Name: 2-(4-hydroxycyclohexyl)-7-[3-oxo-6-(3-pyrrolidinyl)-4H-quinoxalin-2-yl]-1,2-benzothiazol-3-one IUPAC Name: 2-(4-hydroxycyclohexyl)-7-(3-oxo-6-pyrrolidin-3-yl-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one Traditional Name: 2-(4-hydroxycyclohexyl)-7-(3-keto-6-pyrrolidin-3-yl-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2C(=O)C3=C(S2)C(=CC=C3)C4=NC5=C(C=C(C=C5)C6CCNC6)NC4=O)O

Isomeric SMILES

C1CC(CCC1N2C(=O)C3=C(S2)C(=CC=C3)C4=NC5=C(C=C(C=C5)C6CCNC6)NC4=O)O

InChI

InChI=1S/C25H26N4O3S/c30-17-7-5-16(6-8-17)29-25(32)19-3-1-2-18(23(19)33-29)22-24(31)28-21-12-14(4-9-20(21)27-22)15-10-11-26-13-15/h1-4,9,12,15-17,26,30H,5-8,10-11,13H2,(H,28,31)