Vitas-M small molecule compound
N-tert-butyl-3-[(2E)-2-(2-chlorobenzylidene)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinyl]propanamide
Catalog ID
STL291031
SMILES O=C(NC(C)(C)C)CCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1ccccc1Cl
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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 C21H23ClN4O3S MW 446.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4O3S/c1-21(2,3)24-19(27)12-13-26(23-14-15-8-4-6-10-17(15)22)20-16-9-5-7-11-18(16)30(28,29)25-20/h4-11,14H,12-13H2,1-3H3,(H,24,27)/b23-14+InChIKey
HIQMDPCBZFIEIH-OEAKJJBVSA-NSynonyms
CC(C)(C)NC(=O)CCN(C1=NS(=O)(=O)C2=CC=CC=C21)N=CC3=CC=CC=C3Cl
InChI=1SC21H23ClN4O3Sc121(23)2419(27)121326(2314158461017(15)22)20169571118(16)30(2829)2520h41114H1213H213H3(H2427)b2314+
MFCD03215141
Ntertbutyl3(((E)(2chlorophenyl)methylideneamino)(11dioxo12benzothiazol3yl)amino)propanamide
Ntertbutyl3((2E)2(2chlorobenzylidene)1(11dioxido12benzothiazol3yl)hydrazinyl)propanamide
O=C(NC(C)(C)C)CCN(C1=NS(=O)(=O)c2c1cccc2)N=Cc1ccccc1Cl
ZINC000019645488
ZINC103668595
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