methyl (1S,3R,3aS,6aR)-5-ethyl-3-(2-methylpropyl)-4,6-bis(oxidanylidene)-1-(4-propylsulfanylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate

Systemtic Name: methyl (1S,3R,3aS,6aR)-5-ethyl-3-(2-methylpropyl)-4,6-bis(oxidanylidene)-1-(4-propylsulfanylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate Openeye Name: methyl (1S,3R,3aS,6aR)-5-ethyl-3-isobutyl-4,6-dioxo-1-(4-propylsulfanylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate CAS Name: (1S,3R,3aS,6aR)-5-ethyl-3-(2-methylpropyl)-4,6-dioxo-1-[4-(propylthio)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl (1S,3R,3aS,6aR)-5-ethyl-3-(2-methylpropyl)-4,6-dioxo-1-(4-propylsulfanylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate Traditional Name: (1S,3R,3aS,6aR)-5-ethyl-3-isobutyl-4,6-diketo-1-[4-(propylthio)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid methyl ester Formula: C23H32N2O4S MolecularWeight: 432.57618

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)CC)C(N2)(CC(C)C)C(=O)OC

Isomeric SMILES

CCCSC1=CC=C(C=C1)[C@@H]2[C@H]3[C@H](C(=O)N(C3=O)CC)[C@](N2)(CC(C)C)C(=O)OC

InChI

InChI=1S/C23H32N2O4S/c1-6-12-30-16-10-8-15(9-11-16)19-17-18(21(27)25(7-2)20(17)26)23(24-19,13-14(3)4)22(28)29-5/h8-11,14,17-19,24H,6-7,12-13H2,1-5H3/t17-,18-,19-,23-/m1/s1