Vitas-M small molecule compound
(5Z)-5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-3-propyl-2-thioxoimidazolidin-4-one
Catalog ID
STL375258
SMILES CCCN1C(=S)N/C(=C\c2cc(n(c2C)c2ccc(cc2)[N+](=O)[O-])C)/C1=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 C19H20N4O3S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O3S/c1-4-9-21-18(24)17(20-19(21)27)11-14-10-12(2)22(13(14)3)15-5-7-16(8-6-15)23(25)26/h5-8,10-11H,4,9H2,1-3H3,(H,20,27)/b17-11-InChIKey
QIOOYAYYEKTHQI-BOPFTXTBSA-NSynonyms
(5Z)5((25dimethyl1(4nitrophenyl)1Hpyrrol3yl)methylidene)3propyl2thioxoimidazolidin4one
(5Z)5((25DIMETHYL1(4NITROPHENYL)PYRROL3YL)METHYLIDENE)3PROPYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
CCCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)(N+)(=O)(O))C)NC1=S
CCCN1C(=S)NC(=Cc2cc(n(c2C)c2ccc(cc2)(N+)(=O)(O))C)C1=O
InChI=1SC19H20N4O3Sc1492118(24)17(2019(21)27)11141012(2)22(13(14)3)155716(8615)23(25)26h581011H49H213H3(H2027)b1711
MFCD04086876
ZINC000003667617
ZINC03667617
ZINC3667617
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