Vitas-M small molecule compound
N'-[(E)-(3-nitrophenyl)methylidene]-1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinoline-3-carbohydrazide
Catalog ID
STK673439
SMILES CCCS(=O)(=O)c1c(C(=O)N/N=C/c2cccc(c2)[N+](=O)[O-])n2c(c1S(=O)(=O)CCC)c1ccccc1cc2
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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 C26H26N4O7S2 MW 570.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O7S2/c1-3-14-38(34,35)24-22-21-11-6-5-9-19(21)12-13-29(22)23(25(24)39(36,37)15-4-2)26(31)28-27-17-18-8-7-10-20(16-18)30(32)33/h5-13,16-17H,3-4,14-15H2,1-2H3,(H,28,31)/b27-17+InChIKey
IXAJHTMZHUIVMZ-WPWMEQJKSA-NSynonyms
CCCS(=O)(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1S(=O)(=O)CCC)C(=O)NN=CC4=CC(=CC=C4)(N+)(=O)(O)
CCCS(=O)(=O)c1c(C(=O)NN=Cc2cccc(c2)(N+)(=O)(O))n2c(c1S(=O)(=O)CCC)c1ccccc1cc2
InChI=1SC26H26N4O7S2c131438(3435)2422211165919(21)121329(22)23(25(24)39(3637)1542)26(31)28271718871020(1618)30(32)33h5131617H341415H212H3(H2831)b2717+
MFCD01152787
N((E)(3NITROPHENYL)METHYLIDENE)12BIS(PROPYLSULFONYL)PYRROLO(21A)ISOQUINOLINE3CARBOHYDRAZIDE
N((E)(3nitrophenyl)methylideneamino)12bis(propylsulfonyl)pyrrolo(21a)isoquinoline3carboxamide
ZINC000003663779
ZINC102778286
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