Vitas-M small molecule compound
ethyl 4-({[(3R,3'S,5'R)-5-methyl-2-oxo-5'-(propan-2-yl)-1,2-dihydrospiro[indole-3,2'-pyrrolidin]-3'-yl]carbonyl}amino)benzoate
Catalog ID
STL534694
SMILES CCOC(=O)c1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1)C(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 C25H29N3O4 MW 435.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O4/c1-5-32-23(30)16-7-9-17(10-8-16)26-22(29)19-13-21(14(2)3)28-25(19)18-12-15(4)6-11-20(18)27-24(25)31/h6-12,14,19,21,28H,5,13H2,1-4H3,(H,26,29)(H,27,31)/t19-,21-,25+/m1/s1InChIKey
NDMVMKJLUDOUKP-ZJCBTPCYSA-NSynonyms
956924-31-516406540
956924315
CCOC(=O)c1ccc(cc1)NC(=O)(C@H)1C(C@@H)(N(C@@)21C(=O)Nc1c2cc(C)cc1)C(C)C
ethyl4((((3R3S5R)5methyl2oxo5(propan2yl)12dihydrospiro(indole32pyrrolidin)3yl)carbonyl)amino)benzoate
ethyl4(((3~(R)3~(S)5~(R))5methyl2oxo5propan2ylspiro(1~(H)indole32pyrrolidine)3carbonyl)amino)benzoate
ethyl4((2R3S5R)5isopropyl5methyl2oxospiro(indoline32pyrrolidin)3ylcarboxamido)benzoate
InChI=1SC25H29N3O4c153223(30)167917(10816)2622(29)191321(14(2)3)2825(19)181215(4)61120(18)2724(25)31h61214192128H513H214H3(H2629)(H2731)t192125+m1s1
MFCD07637877
ZINC000008876785
ZINC8876785
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