Vitas-M small molecule compound
(2'S,3R,3'S,7a'S)-7''-chloro-2'-[(4-fluorophenyl)carbonyl]-5''-methyl-5',6',7',7a'-tetrahydrodispiro[indole-3,1'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Catalog ID
STK579309
SMILES Fc1ccc(cc1)C(=O)[C@@H]1[C@]2(C(=O)Nc3c2cc(C)cc3Cl)N2[C@H]([C@]31C(=O)Nc1c3cccc1)CCC2
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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 C29H23ClFN3O3 MW 515.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23ClFN3O3/c1-15-13-19-23(20(30)14-15)33-27(37)29(19)25(24(35)16-8-10-17(31)11-9-16)28(22-7-4-12-34(22)29)18-5-2-3-6-21(18)32-26(28)36/h2-3,5-6,8-11,13-14,22,25H,4,7,12H2,1H3,(H,32,36)(H,33,37)/t22-,25-,28+,29+/m0/s1InChIKey
NMHQKIDTOFABHM-JMBFNUQRSA-NSynonyms
1177219-85-0(2S3R3S7aS)7chloro2((4fluorophenyl)carbonyl)5methyl11225677aoctahydro2Hdispiro(indole31pyrrolizine33indole)22dione
(2S3R3S7aS)7chloro2((4fluorophenyl)carbonyl)5methyl5677atetrahydrodispiro(indole31pyrrolizine33indole)22(1H1H)dione
1177219850
CC1=CC(=C2C(=C1)C3(C(C4(C5N3CCC5)C6=CC=CC=C6NC4=O)C(=O)C7=CC=C(C=C7)F)C(=O)N2)Cl
Fc1ccc(cc1)C(=O)(C@@H)1(C@)2(C(=O)Nc3c2cc(C)cc3Cl)N2(C@H)((C@)31C(=O)Nc1c3cccc1)CCC2
InChI=1SC29H23ClFN3O3c115131923(20(30)1415)3327(37)29(19)25(24(35)1681017(31)11916)28(22741234(22)29)18523621(18)3226(28)36h235681113142225H4712H21H3(H3236)(H3337)t222528+29+m0s1
MFCD18245628
ZINC000035374577
ZINC35374577
Check stock
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Check stock on Vitas-MAvailable files
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