Vitas-M small molecule compound
5-methyl-6'-[(4-methylphenyl)carbonyl]-7'-(3-nitrophenyl)-1',6',7',7a'-tetrahydrospiro[indole-3,5'-pyrrolo[1,2-c][1,3]thiazol]-2(1H)-one
Catalog ID
STL043043
SMILES Cc1ccc2c(c1)C1(C(=O)N2)C(C(=O)c2ccc(cc2)C)C(C2N1CSC2)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 C28H25N3O4S MW 499.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O4S/c1-16-6-9-18(10-7-16)26(32)25-24(19-4-3-5-20(13-19)31(34)35)23-14-36-15-30(23)28(25)21-12-17(2)8-11-22(21)29-27(28)33/h3-13,23-25H,14-15H2,1-2H3,(H,29,33)InChIKey
DCAZCKMMEAPQGQ-UHFFFAOYSA-NSynonyms
(3S)5methyl6(4methylbenzoyl)7(3nitrophenyl)3677atetrahydro1Hspiro(indoline35pyrrolo(12c)thiazol)2one
5methyl6((4methylphenyl)carbonyl)7(3nitrophenyl)1677atetrahydrospiro(indole35pyrrolo(12c)(13)thiazol)2(1H)one
5methyl6(4methylbenzoyl)7(3nitrophenyl)spiro(1Hindole353677atetrahydro1Hpyrrolo(12c)(13)thiazole)2one
CC1=CC=C(C=C1)C(=O)C2C(C3CSCN3C24C5=C(C=CC(=C5)C)NC4=O)C6=CC(=CC=C6)(N+)(=O)(O)
Cc1ccc2c(c1)(C@)1(C(=O)N2)C(C(=O)c2ccc(cc2)C)C(C2N1CSC2)c1cccc(c1)(N+)(=O)(O)
Cc1ccc2c(c1)C1(C(=O)N2)C(C(=O)c2ccc(cc2)C)C(C2N1CSC2)c1cccc(c1)(N+)(=O)(O)
InChI=1SC28H25N3O4Sc1166918(10716)26(32)2524(1943520(1319)31(34)35)2314361530(23)28(25)211217(2)81122(21)2927(28)33h3132325H1415H212H3(H2933)
MFCD18192523
ZINC000035851961
ZINC000106015540
Check stock
See real-time availability and sample size for STL043043 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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