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ethyl 2-[(3a'S,6a'R)-3'-(3-amino-3-oxopropyl)-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK594491
SMILES CCOC(=O)c1c(sc2c1CCC2)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C26H26N4O6S MW 522.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O6S/c1-2-36-24(34)18-12-6-5-9-16(12)37-23(18)30-21(32)19-15(10-11-17(27)31)29-26(20(19)22(30)33)13-7-3-4-8-14(13)28-25(26)35/h3-4,7-8,15,19-20,29H,2,5-6,9-11H2,1H3,(H2,27,31)(H,28,35)/t15?,19-,20+,26?/m1/s1
InChIKey
RYNCOXCQSCAITC-RALAOVQUSA-N
Synonyms
1014022-72-0
1014022720
CCOC(=O)C1=C(SC2=C1CCC2)N3C(=O)C4C(NC5(C4C3=O)C6=CC=CC=C6NC5=O)CCC(=O)N
CCOC(=O)c1c(sc2c1CCC2)N1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cccc2
ethyl2((3aR6aS)1(3amino3oxopropyl)246trioxospiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)5yl)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ethyl2((3aS6aR)3(3amino3oxopropyl)246trioxo12233a466aoctahydro5Hspiro(indole31pyrrolo(34c)pyrrol)5yl)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ethyl2((3aS6aR)3(3amino3oxopropyl)246trioxo3a466atetrahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)5(3H)yl)56dihydro4Hcyclopenta(b)thiophene3carboxylate
InChI=1SC26H26N4O6Sc123624(34)181265916(12)3723(18)3021(32)1915(101117(27)31)2926(20(19)22(30)33)13734814(13)2825(26)35h347815192029H256911H21H3(H22731)(H2835)t15?1920+26?m1s1
MFCD06775625
ZINC000013555666
ZINC000020546646

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Available files

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