Vitas-M small molecule compound
(2E)-2-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzylidene}-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Catalog ID
STL308221
SMILES C=CCNC(=S)N/N=C/c1ccc(c(c1)Cn1ncc(c1)[N+](=O)[O-])OC
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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 C16H18N6O3S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6O3S/c1-3-6-17-16(26)20-18-8-12-4-5-15(25-2)13(7-12)10-21-11-14(9-19-21)22(23)24/h3-5,7-9,11H,1,6,10H2,2H3,(H2,17,20,26)/b18-8+InChIKey
BSAOWQDRMYYMDT-QGMBQPNBSA-NSynonyms
955900-27-3(((1E)2(4METHOXY3((4NITROPYRAZOLYL)METHYL)PHENYL)1AZAVINYL)AMINO)(PROP2ENYLAMINO)METHANE1THIONE
(2E)2(4methoxy3((4nitro1Hpyrazol1yl)methyl)benzylidene)N(prop2en1yl)hydrazinecarbothioamide
(E)Nallyl2(4methoxy3((4nitro1Hpyrazol1yl)methyl)benzylidene)hydrazinecarbothioamide
1((E)(4METHOXY3((4NITROPYRAZOL1YL)METHYL)PHENYL)METHYLIDENEAMINO)3PROP2ENYLTHIOUREA
955900273
C=CCNC(=S)NN=Cc1ccc(c(c1)Cn1ncc(c1)(N+)(=O)(O))OC
COC1=C(C=C(C=C1)C=NNC(=S)NCC=C)CN2C=C(C=N2)(N+)(=O)(O)
InChI=1SC16H18N6O3Sc1361716(26)20188124515(252)13(712)10211114(91921)22(23)24h357911H1610H22H3(H2172026)b188+
MFCD03562621
ZINC000002224466
ZINC33350927
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