Vitas-M small molecule compound
5,7-dimethyl-7'-(3-nitrophenyl)-6'-(phenylcarbonyl)-1',6',7',7a'-tetrahydrospiro[indole-3,5'-pyrrolo[1,2-c][1,3]thiazol]-2(1H)-one
Catalog ID
STL042975
SMILES Cc1cc(C)c2c(c1)C1(C(=O)N2)C(C(C2N1CSC2)c1cccc(c1)[N+](=O)[O-])C(=O)c1ccccc1
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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 C28H25N3O4S MW 499.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O4S/c1-16-11-17(2)25-21(12-16)28(27(33)29-25)24(26(32)18-7-4-3-5-8-18)23(22-14-36-15-30(22)28)19-9-6-10-20(13-19)31(34)35/h3-13,22-24H,14-15H2,1-2H3,(H,29,33)InChIKey
AEMQDLSNILVURF-UHFFFAOYSA-NSynonyms
(3S)6benzoyl57dimethyl7(3nitrophenyl)3677atetrahydro1Hspiro(indoline35pyrrolo(12c)thiazol)2one
57dimethyl7(3nitrophenyl)6(phenylcarbonyl)1677atetrahydrospiro(indole35pyrrolo(12c)(13)thiazol)2(1H)one
6benzoyl57dimethyl7(3nitrophenyl)spiro(1Hindole353677atetrahydro1Hpyrrolo(12c)(13)thiazole)2one
CC1=CC(=C2C(=C1)C3(C(C(C4N3CSC4)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)C6=CC=CC=C6)C(=O)N2)C
Cc1cc(C)c2c(c1)(C@)1(C(=O)N2)C(C(C2N1CSC2)c1cccc(c1)(N+)(=O)(O))C(=O)c1ccccc1
Cc1cc(C)c2c(c1)C1(C(=O)N2)C(C(C2N1CSC2)c1cccc(c1)(N+)(=O)(O))C(=O)c1ccccc1
InChI=1SC28H25N3O4Sc1161117(2)2521(1216)28(27(33)2925)24(26(32)187435818)23(2214361530(22)28)19961020(1319)31(34)35h3132224H1415H212H3(H2933)
MFCD18192510
ZINC000013541242
ZINC000036319058
Check stock
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Check stock on Vitas-MAvailable files
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