Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-8-[(4-bromophenyl)carbonyl]-10-(4-butoxyphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK539954
SMILES CCCCOc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2c2ccccc2C=C1)C(=O)c1ccc(cc1)Br
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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 C31H27BrN2O4 MW 571.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27BrN2O4/c1-2-3-18-38-23-14-12-22(13-15-23)34-30(36)25-26(31(34)37)28(29(35)20-8-10-21(32)11-9-20)33-17-16-19-6-4-5-7-24(19)27(25)33/h4-17,25-28H,2-3,18H2,1H3/t25-,26+,27+,28-/m0/s1InChIKey
BYCNRKJSZUUCTJ-HFLBTKGNSA-NSynonyms
(8S8aR11aS11bS)8((4bromophenyl)carbonyl)10(4butoxyphenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS11bS)8(4bromobenzoyl)10(4butoxyphenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
CCCCOC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=C(C=C6)Br
CCCCOc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1(C@@H)2c2ccccc2C=C1)C(=O)c1ccc(cc1)Br
InChI=1SC31H27BrN2O4c123183823141222(131523)3430(36)2526(31(34)37)28(29(35)2081021(32)11920)33171619645724(19)27(25)33h4172528H2318H21H3t2526+27+28m0s1
MFCD18241799
ZINC000102426070
ZINC102426070
Check stock
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Check stock on Vitas-MAvailable files
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