(1S,3S,3aR,6aS)-5-cyclopentyl-5',7'-dimethyl-1-(2-methylsulfanylethyl)spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-1H-indole]-2',4,6-trione

Systemtic Name: (1S,3S,3aR,6aS)-5-cyclopentyl-5',7'-dimethyl-1-(2-methylsulfanylethyl)spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-1H-indole]-2',4,6-trione Openeye Name: (1S,3S,3aR,6aS)-5-cyclopentyl-5',7'-dimethyl-1-(2-methylsulfanylethyl)spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-indoline]-2',4,6-trione CAS Name: (1S,3S,3aR,6aS)-5-cyclopentyl-5',7'-dimethyl-1-[2-(methylthio)ethyl]spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-1H-indole]-2',4,6-trione IUPAC Name: (1S,3S,3aR,6aS)-5-cyclopentyl-5',7'-dimethyl-1-(2-methylsulfanylethyl)spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-1H-indole]-2',4,6-trione Traditional Name: (1S,3S,3aR,6aS)-5-cyclopentyl-5',7'-dimethyl-1-[2-(methylthio)ethyl]spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-indoline]-2',4,6-trione Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C3(C4C(C([NH2+]3)CCSC)C(=O)N(C4=O)C5CCCC5)C(=O)N2)C

Isomeric SMILES

CC1=CC(=C2C(=C1)[C@@]3([C@H]4[C@@H]([C@@H]([NH2+]3)CCSC)C(=O)N(C4=O)C5CCCC5)C(=O)N2)C

InChI

InChI=1S/C23H29N3O3S/c1-12-10-13(2)19-15(11-12)23(22(29)24-19)18-17(16(25-23)8-9-30-3)20(27)26(21(18)28)14-6-4-5-7-14/h10-11,14,16-18,25H,4-9H2,1-3H3,(H,24,29)/p+1/t16-,17+,18-,23+/m0/s1