Vitas-M small molecule compound
5'-methyl-2'-{[4-(2-methylpropyl)phenyl]carbonyl}-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL056136
SMILES CC(Cc1ccc(cc1)C(=O)C1C(C(=O)c2cccs2)N2C(C31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C)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 C36H32N2O3S MW 572.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H32N2O3S/c1-21(2)19-23-14-16-24(17-15-23)33(39)31-32(34(40)29-13-8-18-42-29)38-28-12-7-4-9-25(28)22(3)20-30(38)36(31)26-10-5-6-11-27(26)37-35(36)41/h4-18,20-21,30-32H,19H2,1-3H3,(H,37,41)InChIKey
FXHZZFGCWKLNBS-UHFFFAOYSA-NSynonyms
(1S2S3R3aR)2(4isobutylbenzoyl)5methyl1(thiophene2carbonyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
5methyl2((4(2methylpropyl)phenyl)carbonyl)1(thiophen2ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
5methyl2(4(2methylpropyl)benzoyl)1(thiophene2carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
CC(Cc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2cccs2)N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C)C
CC1=CC2C3(C(C(N2C4=CC=CC=C14)C(=O)C5=CC=CS5)C(=O)C6=CC=C(C=C6)CC(C)C)C7=CC=CC=C7NC3=O
InChI=1SC36H32N2O3Sc121(2)1923141624(171523)33(39)3132(34(40)29138184229)38281274925(28)22(3)2030(38)36(31)2610561127(26)3735(36)41h41820213032H19H213H3(H3741)
MFCD05738309
ZINC000229953995
ZINC000245245684
Check stock
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Check stock on Vitas-MAvailable files
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