(5R,5aR,8aS)-5-(4-chlorophenyl)-7-ethyl-2-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione

Systemtic Name: (5R,5aR,8aS)-5-(4-chlorophenyl)-7-ethyl-2-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione Openeye Name: (5R,5aR,8aS)-5-(4-chlorophenyl)-7-ethyl-2-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione CAS Name: (5R,5aR,8aS)-5-(4-chlorophenyl)-7-ethyl-2-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione IUPAC Name: (5R,5aR,8aS)-5-(4-chlorophenyl)-7-ethyl-2-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione Traditional Name: (5R,5aR,8aS)-5-(4-chlorophenyl)-7-ethyl-2-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-quinone Formula: C23H19ClN2O2S MolecularWeight: 422.92716

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2C(CC3=C(C2C1=O)SC(=N3)C4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCN1C(=O)[C@@H]2[C@@H](CC3=C([C@@H]2C1=O)SC(=N3)C4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H19ClN2O2S/c1-2-26-22(27)18-16(13-8-10-15(24)11-9-13)12-17-20(19(18)23(26)28)29-21(25-17)14-6-4-3-5-7-14/h3-11,16,18-19H,2,12H2,1H3/t16-,18+,19+/m0/s1