Vitas-M small molecule compound
10-(2,6-dimethylphenyl)-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
STL245396
SMILES O=C(C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1c(C)cccc1C)cccc3)c1cccs1
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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 C27H22N2O3S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O3S/c1-15-7-5-8-16(2)22(15)29-26(31)20-21(27(29)32)24(25(30)19-11-6-14-33-19)28-13-12-17-9-3-4-10-18(17)23(20)28/h3-14,20-21,23-24H,1-2H3InChIKey
SIESXJHQNFCDPY-UHFFFAOYSA-NSynonyms
(8S8aR11aS)10(26dimethylphenyl)8(thiophene2carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
10(26dimethylphenyl)8(thiophen2ylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
CC1=C(C(=CC=C1)C)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=CS6
InChI=1SC27H22N2O3Sc11575816(2)22(15)2926(31)2021(27(29)32)24(25(30)19116143319)281312179341018(17)23(20)28h31420212324H12H3
MFCD24860252
O=C((C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1c(C)cccc1C)cccc3)c1cccs1
ZINC000013788018
ZINC000247884707
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