Vitas-M small molecule compound
10-(5-chloro-2-methylphenyl)-8-(thiophen-2-ylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL346776
SMILES Clc1ccc(c(c1)N1C(=O)C2C(C1=O)C1N(C2C(=O)c2cccs2)C=Cc2c1cccc2)C
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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 C26H19ClN2O3S MW 474.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19ClN2O3S/c1-14-8-9-16(27)13-18(14)29-25(31)20-21(26(29)32)23(24(30)19-7-4-12-33-19)28-11-10-15-5-2-3-6-17(15)22(20)28/h2-13,20-23H,1H3InChIKey
IFFGIPWNYOMBLL-UHFFFAOYSA-NSynonyms
(8S8aR11aS)10(5chloro2methylphenyl)8(thiophene2carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
10(5chloro2methylphenyl)8(thiophen2ylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
CC1=C(C=C(C=C1)Cl)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=CS6
Clc1ccc(c(c1)N1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)c2cccs2)C=Cc2c1cccc2)C
InChI=1SC26H19ClN2O3Sc1148916(27)1318(14)2925(31)2021(26(29)32)23(24(30)1974123319)28111015523617(15)22(20)28h2132023H1H3
MFCD28032228
ZINC000016000128
ZINC000245310335
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