Vitas-M small molecule compound
3-butyl-5,5-dimethyl-4-[(Z)-(3-nitrobenzylidene)(oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Catalog ID
STK699623
SMILES CCCCN1C(=S)SC(C1/[N+](=C/c1cccc(c1)[N+](=O)[O-])/[O-])(C)C
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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 C16H21N3O3S2 MW 367.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O3S2/c1-4-5-9-17-14(16(2,3)24-15(17)23)18(20)11-12-7-6-8-13(10-12)19(21)22/h6-8,10-11,14H,4-5,9H2,1-3H3/b18-11-InChIKey
YXDCAEZGBASRPM-WQRHYEAKSA-NSynonyms
(Z)3butyl55dimethylN(3nitrobenzylidene)2thioxothiazolidin4amineoxide
3butyl55dimethyl4((Z)(3nitrobenzylidene)(oxido)lambda~5~azanyl)13thiazolidine2thione
3BUTYL55DIMETHYL4((Z)(3NITROBENZYLIDENE)(OXIDO)LAMBDA5AZANYL)13THIAZOLIDINE2THIONE
CCCCN1C(=S)SC(C1(N+)(=Cc1cccc(c1)(N+)(=O)(O))(O))(C)C
CCCCN1C(C(SC1=S)(C)C)(N+)(=CC2=CC(=CC=C2)(N+)(=O)(O))(O)
InChI=1SC16H21N3O3S2c14591714(16(23)2415(17)23)18(20)111276813(1012)19(21)22h68101114H459H213H3b1811
MFCD01562228
N(3BUTYL55DIMETHYL2SULFANYLIDENE13THIAZOLIDIN4YL)1(3NITROPHENYL)METHANIMINEOXIDE
ZINC000001833547
ZINC000001833549
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