Vitas-M small molecule compound
4-(3-{[{(2E)-2-[4-(1,3-benzodioxol-5-yl)butan-2-ylidene]hydrazinyl}(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid
Catalog ID
STK674793
SMILES N=C(SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O)N/N=C(/CCc1ccc2c(c1)OCO2)\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 C23H22N4O6S MW 482.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O6S/c1-13(2-3-14-4-9-17-18(10-14)33-12-32-17)25-26-23(24)34-19-11-20(28)27(21(19)29)16-7-5-15(6-8-16)22(30)31/h4-10,19H,2-3,11-12H2,1H3,(H2,24,26)(H,30,31)/b25-13+InChIKey
YKHVUZBACUBZFM-DHRITJCHSA-NSynonyms
4(3((((2E)2(4(13benzodioxol5yl)butan2ylidene)hydrazinyl)(imino)methyl)sulfanyl)25dioxopyrrolidin1yl)benzoicacid
4(3((E)N((E)4(13benzodioxol5yl)butan2ylideneamino)carbamimidoyl)sulfanyl25dioxopyrrolidin1yl)benzoicacid
CC(=NN=C(N)SC1CC(=O)N(C1=O)C2=CC=C(C=C2)C(=O)O)CCC3=CC4=C(C=C3)OCO4
InChI=1SC23H22N4O6Sc113(2314491718(1014)33123217)252623(24)34191120(28)27(21(19)29)167515(6816)22(30)31h41019H231112H21H3(H22426)(H3031)b2513+
MFCD01036563
N=C(SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O)NN=C(CCc1ccc2c(c1)OCO2)C
ZINC000015188404
ZINC000100071983
Check stock
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Check stock on Vitas-MAvailable files
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