Vitas-M small molecule compound
(5E)-5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-3-(tetrahydrofuran-2-ylmethyl)-2-thioxoimidazolidin-4-one
Catalog ID
STL176496
SMILES S=C1N/C(=C/c2ccc(o2)c2ccc(cc2Cl)[N+](=O)[O-])/C(=O)N1CC1CCCO1
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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 C19H16ClN3O5S MW 433.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O5S/c20-15-8-11(23(25)26)3-5-14(15)17-6-4-12(28-17)9-16-18(24)22(19(29)21-16)10-13-2-1-7-27-13/h3-6,8-9,13H,1-2,7,10H2,(H,21,29)/b16-9+InChIKey
YSIDDMIHKPDUDK-CXUHLZMHSA-NSynonyms
678158-56-0(5E)5((5(2CHLORO4NITROPHENYL)FURAN2YL)METHYLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5E)5((5(2chloro4nitrophenyl)furan2yl)methylidene)3(tetrahydrofuran2ylmethyl)2thioxoimidazolidin4one
678158560
C1CC(OC1)CN2C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)(N+)(=O)(O))Cl)NC2=S
InChI=1SC19H16ClN3O5Sc2015811(23(25)26)3514(15)176412(2817)91618(24)22(19(29)2116)10132172713h368913H12710H2(H2129)b169+
MFCD04048974
S=C1NC(=Cc2ccc(o2)c2ccc(cc2Cl)(N+)(=O)(O))C(=O)N1CC1CCCO1
ZINC000020602292
ZINC000020602293
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