Vitas-M small molecule compound

1'-(4-chlorophenyl)-8-nitro-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxamide

Catalog ID
STK685735
SMILES NC(=O)C1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl

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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 C23H20ClN5O6 MW 497.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN5O6/c24-14-1-3-15(4-2-14)28-21(32)23(20(31)26-22(28)33)11-13-9-16(29(34)35)5-6-17(13)27-8-7-12(19(25)30)10-18(23)27/h1-6,9,12,18H,7-8,10-11H2,(H2,25,30)(H,26,31,33)
InChIKey
KVVYMIKSWPHUSH-UHFFFAOYSA-N
Synonyms

1(4chlorophenyl)8nitro246trioxo1233444a6octahydro1H2H6Hspiro(pyrido(12a)quinoline55pyrimidine)3carboxamide
1(4chlorophenyl)8nitro246trioxospiro(12344a6hexahydrobenzo(f)quinolizine5513diazinane)3carboxamide
C1CN2C(CC1C(=O)N)C3(CC4=C2C=CC(=C4)(N+)(=O)(O))C(=O)NC(=O)N(C3=O)C5=CC=C(C=C5)Cl
InChI=1SC23H20ClN5O6c24141315(4214)2821(32)23(20(31)2622(28)33)1113916(29(34)35)5617(13)278712(19(25)30)1018(23)27h1691218H781011H2(H22530)(H263133)
MFCD05860467
NC(=O)C1CCN2C(C1)C1(Cc3c2ccc(c3)(N+)(=O)(O))C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
ZINC000012374508
ZINC000247712546

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Available files

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