Vitas-M small molecule compound
2-amino-1-(2-chloro-4-nitrophenyl)-7,7-dimethyl-4-(5-nitrothiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK784362
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(s1)[N+](=O)[O-])C(=O)CC(C2)(C)C)c1ccc(cc1Cl)[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 C22H18ClN5O5S MW 499.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN5O5S/c1-22(2)8-15-20(16(29)9-22)19(17-5-6-18(34-17)28(32)33)12(10-24)21(25)26(15)14-4-3-11(27(30)31)7-13(14)23/h3-7,19H,8-9,25H2,1-2H3InChIKey
VEVJBXZKCUJJHA-UHFFFAOYSA-NSynonyms
2amino1(2chloro4nitrophenyl)77dimethyl4(5nitrothiophen2yl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO1(2CHLORO4NITROPHENYL)77DIMETHYL4(5NITROTHIOPHEN2YL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=C(C=C(C=C3)(N+)(=O)(O))Cl)N)C#N)C4=CC=C(S4)(N+)(=O)(O))C(=O)C1)C
InChI=1SC22H18ClN5O5Sc122(2)81520(16(29)922)19(175618(3417)28(32)33)12(1024)21(25)26(15)144311(27(30)31)713(14)23h3719H8925H212H3
MFCD07021934
N#CC1=C(N)N(C2=C(C1c1ccc(s1)(N+)(=O)(O))C(=O)CC(C2)(C)C)c1ccc(cc1Cl)(N+)(=O)(O)
ZINC000012402317
ZINC000012402318
Check stock
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