3-(1H-indol-3-ylmethyl)-4,6-bis(oxidanylidene)-5-(2-pyridin-2-ylethyl)-1-(1,3-thiazol-2-yl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-(1H-indol-3-ylmethyl)-4,6-bis(oxidanylidene)-5-(2-pyridin-2-ylethyl)-1-(1,3-thiazol-2-yl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 3-(1H-indol-3-ylmethyl)-4,6-dioxo-5-[2-(2-pyridyl)ethyl]-1-thiazol-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-(1H-indol-3-ylmethyl)-4,6-dioxo-5-[2-(2-pyridinyl)ethyl]-1-(2-thiazolyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-(1H-indol-3-ylmethyl)-4,6-dioxo-5-(2-pyridin-2-ylethyl)-1-(1,3-thiazol-2-yl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 3-(1H-indol-3-ylmethyl)-4,6-diketo-5-[2-(2-pyridyl)ethyl]-1-thiazol-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C26H23N5O4S MolecularWeight: 501.55692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC3(C4C(C(N3)C5=NC=CS5)C(=O)N(C4=O)CCC6=CC=CC=N6)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC3(C4C(C(N3)C5=NC=CS5)C(=O)N(C4=O)CCC6=CC=CC=N6)C(=O)O

InChI

InChI=1S/C26H23N5O4S/c32-23-19-20(24(33)31(23)11-8-16-5-3-4-9-27-16)26(25(34)35,30-21(19)22-28-10-12-36-22)13-15-14-29-18-7-2-1-6-17(15)18/h1-7,9-10,12,14,19-21,29-30H,8,11,13H2,(H,34,35)