Vitas-M small molecule compound
10-(4-acetylphenyl)-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
STL346550
SMILES CC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C(N1C2c2ccccc2C=C1)C(=O)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 C27H20N2O4S MW 468.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N2O4S/c1-15(30)16-8-10-18(11-9-16)29-26(32)21-22(27(29)33)24(25(31)20-7-4-14-34-20)28-13-12-17-5-2-3-6-19(17)23(21)28/h2-14,21-24H,1H3InChIKey
XVMJVXLULUFIIB-UHFFFAOYSA-NSynonyms
(8S8aR11aS)10(4acetylphenyl)8(thiophene2carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
10(4acetylphenyl)8(thiophen2ylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
CC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=CS6
CC(=O)c1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1C2c2ccccc2C=C1)C(=O)c1cccs1
InChI=1SC27H20N2O4Sc115(30)1681018(11916)2926(32)2122(27(29)33)24(25(31)2074143420)28131217523619(17)23(21)28h2142124H1H3
MFCD28032213
ZINC000015999269
ZINC000245312840
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