Vitas-M small molecule compound
1-(3-nitrophenyl)-2,5-dioxopyrrolidin-3-yl (2E)-2-(1-phenylpentylidene)hydrazinecarbimidothioate
Catalog ID
STK373357
SMILES CCCC/C(=N\NC(=N)SC1CC(=O)N(C1=O)c1cccc(c1)[N+](=O)[O-])/c1ccccc1
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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 C22H23N5O4S MW 453.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O4S/c1-2-3-12-18(15-8-5-4-6-9-15)24-25-22(23)32-19-14-20(28)26(21(19)29)16-10-7-11-17(13-16)27(30)31/h4-11,13,19H,2-3,12,14H2,1H3,(H2,23,25)/b24-18+InChIKey
NOSXWPBGDZCKRP-HKOYGPOVSA-NSynonyms
(1(3nitrophenyl)25dioxopyrrolidin3yl)N((E)1phenylpentylideneamino)carbamimidothioate
1(3nitrophenyl)25dioxopyrrolidin3yl(2E)2(1phenylpentylidene)hydrazinecarbimidothioate
3((((1E)2PHENYL1AZAHEX1ENYL)AMINO)IMINOMETHYLTHIO)1(3NITROPHENYL)AZOLIDINE25DIONE
CCCCC(=NN=C(N)SC1CC(=O)N(C1=O)C2=CC(=CC=C2)(N+)(=O)(O))C3=CC=CC=C3
CCCCC(=NNC(=N)SC1CC(=O)N(C1=O)c1cccc(c1)(N+)(=O)(O))c1ccccc1
InChI=1SC22H23N5O4Sc1231218(158546915)242522(23)32191420(28)26(21(19)29)161071117(1316)27(30)31h4111319H231214H21H3(H22325)b2418+
MFCD00574281
ZINC000004100104
ZINC000100331537
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