Vitas-M small molecule compound

5-fluoro-7'-(4-nitrophenyl)-6'-(pyridin-3-ylcarbonyl)-1',6',7',7a'-tetrahydrospiro[indole-3,5'-pyrrolo[1,2-c][1,3]thiazol]-2(1H)-one

Catalog ID
STL058207
SMILES Fc1ccc2c(c1)C1(C(=O)N2)N2CSCC2C(C1C(=O)c1cccnc1)c1ccc(cc1)[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 C25H19FN4O4S MW 490.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19FN4O4S/c26-16-5-8-19-18(10-16)25(24(32)28-19)22(23(31)15-2-1-9-27-11-15)21(20-12-35-13-29(20)25)14-3-6-17(7-4-14)30(33)34/h1-11,20-22H,12-13H2,(H,28,32)
InChIKey
RRANEJOVMWVIMH-UHFFFAOYSA-N
Synonyms

(3S)5fluoro6nicotinoyl7(4nitrophenyl)3677atetrahydro1Hspiro(indoline35pyrrolo(12c)thiazol)2one
5fluoro7(4nitrophenyl)6(pyridin3ylcarbonyl)1677atetrahydrospiro(indole35pyrrolo(12c)(13)thiazol)2(1H)one
5fluoro7(4nitrophenyl)6(pyridine3carbonyl)spiro(1Hindole353677atetrahydro1Hpyrrolo(12c)(13)thiazole)2one
C1C2C(C(C3(N2CS1)C4=C(C=CC(=C4)F)NC3=O)C(=O)C5=CN=CC=C5)C6=CC=C(C=C6)(N+)(=O)(O)
Fc1ccc2c(c1)(C@@)1(C(=O)N2)N2CSCC2C(C1C(=O)c1cccnc1)c1ccc(cc1)(N+)(=O)(O)
Fc1ccc2c(c1)C1(C(=O)N2)N2CSCC2C(C1C(=O)c1cccnc1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H19FN4O4Sc2616581918(1016)25(24(32)2819)22(23(31)15219271115)21(2012351329(20)25)143617(7414)30(33)34h1112022H1213H2(H2832)
MFCD18192932
ZINC000020518801
ZINC000230099658

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Available files

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