Vitas-M small molecule compound
1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl (2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinecarbimidothioate
Catalog ID
STK369447
SMILES CCCCOc1ccc(cc1)N1C(=O)CC(C1=O)SC(=N)N/N=C/c1ccc2c(c1)OCO2
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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 C23H24N4O5S MW 468.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O5S/c1-2-3-10-30-17-7-5-16(6-8-17)27-21(28)12-20(22(27)29)33-23(24)26-25-13-15-4-9-18-19(11-15)32-14-31-18/h4-9,11,13,20H,2-3,10,12,14H2,1H3,(H2,24,26)/b25-13+InChIKey
PIDKZWHDDFAHBF-DHRITJCHSA-NSynonyms
294656-20-5(1(4butoxyphenyl)25dioxopyrrolidin3yl)N((E)13benzodioxol5ylmethylideneamino)carbamimidothioate
1(4butoxyphenyl)25dioxopyrrolidin3yl(2E)2(13benzodioxol5ylmethylidene)hydrazinecarbimidothioate
294656205
CCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC(=NN=CC3=CC4=C(C=C3)OCO4)N
CCCCOc1ccc(cc1)N1C(=O)CC(C1=O)SC(=N)NN=Cc1ccc2c(c1)OCO2
InChI=1SC23H24N4O5Sc1231030177516(6817)2721(28)1220(22(27)29)3323(24)26251315491819(1115)32143118h49111320H23101214H21H3(H22426)b2513+
MFCD00627758
ZINC000002771195
ZINC000004673637
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