Vitas-M small molecule compound
(2'S,3R,7a'S)-N-(4-fluorophenyl)-5-methyl-2-oxo-1,1',2,2',5',6',7',7a'-octahydrospiro[indole-3,3'-pyrrolizine]-2'-carboxamide
Catalog ID
STK590039
SMILES O=C([C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cc(C)cc1)CCC2)Nc1ccc(cc1)F
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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 C22H22FN3O2 MW 379.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN3O2/c1-13-4-9-19-17(11-13)22(21(28)25-19)18(12-16-3-2-10-26(16)22)20(27)24-15-7-5-14(23)6-8-15/h4-9,11,16,18H,2-3,10,12H2,1H3,(H,24,27)(H,25,28)/t16-,18+,22-/m0/s1InChIKey
HMWRHXHEXYTHQM-CECAUBDESA-NSynonyms
1214633-25-6(2S3R7aS)N(4fluorophenyl)5methyl2oxo11225677aoctahydrospiro(indole33pyrrolizine)2carboxamide
(2S3R7aS)N(4fluorophenyl)5methyl2oxo125677ahexahydrospiro(indoline33pyrrolizine)2carboxamide
(2S3R8S)N(4fluorophenyl)5methyl2oxospiro(125678hexahydropyrrolizine331Hindole)2carboxamide
1214633256
CC1=CC2=C(C=C1)NC(=O)C23C(CC4N3CCC4)C(=O)NC5=CC=C(C=C5)F
InChI=1SC22H22FN3O2c113491917(1113)22(21(28)2519)18(1216321026(16)22)20(27)24157514(23)6815h49111618H231012H21H3(H2427)(H2528)t1618+22m0s1
MFCD08284496
O=C((C@H)1C(C@H)2N((C@@)31C(=O)Nc1c3cc(C)cc1)CCC2)Nc1ccc(cc1)F
ZINC000057121070
ZINC57121070
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