Vitas-M small molecule compound
(1'S,2'S,3R,3a'R)-7'-chloro-2'-[(3-nitrophenyl)carbonyl]-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL053488
SMILES Clc1ccc2c(c1)C=C[C@H]1N2[C@H](C(=O)c2cccs2)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)[N+](=O)[O-]
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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 C31H20ClN3O5S MW 582.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H20ClN3O5S/c32-19-11-12-23-17(15-19)10-13-25-31(21-7-1-2-8-22(21)33-30(31)38)26(27(34(23)25)29(37)24-9-4-14-41-24)28(36)18-5-3-6-20(16-18)35(39)40/h1-16,25-27H,(H,33,38)/t25-,26+,27+,31-/m1/s1InChIKey
LRNYNWZTGLBQKI-ANOKCIKSSA-NSynonyms
(1S2S3R3aR)7chloro2((3nitrophenyl)carbonyl)1(thiophen2ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)7chloro2(3nitrobenzoyl)1(thiophene2carbonyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
(1S2S3R3aR)7chloro2(3nitrobenzoyl)1(thiophene2carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
C1=CC=C2C(=C1)C3(C4C=CC5=C(N4C(C3C(=O)C6=CC(=CC=C6)(N+)(=O)(O))C(=O)C7=CC=CS7)C=CC(=C5)Cl)C(=O)N2
Clc1ccc2c(c1)C=C(C@H)1N2(C@H)(C(=O)c2cccs2)(C@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC31H20ClN3O5Sc321911122317(1519)10132531(21712822(21)3330(31)38)26(27(34(23)25)29(37)2494144124)28(36)1853620(1618)35(39)40h1162527H(H3338)t2526+27+31m1s1
MFCD18192728
ZINC000102893263
ZINC102893263
Check stock
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