(4S,5R,5aR,8aS)-4-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]-5-(4-chlorophenyl)-2-methyl-7-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione

Systemtic Name: (4S,5R,5aR,8aS)-4-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]-5-(4-chlorophenyl)-2-methyl-7-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione Openeye Name: (4S,5R,5aR,8aS)-5-(4-chlorophenyl)-4-(2,5-dioxo-1-phenyl-pyrrolidin-3-yl)-2-methyl-7-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione CAS Name: (4S,5R,5aR,8aS)-5-(4-chlorophenyl)-4-(2,5-dioxo-1-phenyl-3-pyrrolidinyl)-2-methyl-7-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione IUPAC Name: (4S,5R,5aR,8aS)-5-(4-chlorophenyl)-4-(2,5-dioxo-1-phenylpyrrolidin-3-yl)-2-methyl-7-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-dione Traditional Name: (4S,5R,5aR,8aS)-5-(4-chlorophenyl)-4-(2,5-diketo-1-phenyl-pyrrolidin-3-yl)-2-methyl-7-phenyl-4,5,5a,8a-tetrahydropyrrolo[3,4-g][1,3]benzothiazole-6,8-quinone Formula: C32H24ClN3O4S MolecularWeight: 582.06866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C3C(C(C2C4CC(=O)N(C4=O)C5=CC=CC=C5)C6=CC=C(C=C6)Cl)C(=O)N(C3=O)C7=CC=CC=C7

Isomeric SMILES

CC1=NC2=C(S1)[C@H]3[C@@H]([C@@H]([C@H]2C4CC(=O)N(C4=O)C5=CC=CC=C5)C6=CC=C(C=C6)Cl)C(=O)N(C3=O)C7=CC=CC=C7

InChI

InChI=1S/C32H24ClN3O4S/c1-17-34-28-25(22-16-23(37)35(30(22)38)20-8-4-2-5-9-20)24(18-12-14-19(33)15-13-18)26-27(29(28)41-17)32(40)36(31(26)39)21-10-6-3-7-11-21/h2-15,22,24-27H,16H2,1H3/t22?,24-,25-,26-,27-/m1/s1