Vitas-M small molecule compound
N-({3-methoxy-4-[(2-methylpropanoyl)amino]phenyl}carbamothioyl)-1,3-benzodioxole-5-carboxamide
Catalog ID
STK893106
SMILES COc1cc(ccc1NC(=O)C(C)C)NC(=S)NC(=O)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 C20H21N3O5S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5S/c1-11(2)18(24)22-14-6-5-13(9-16(14)26-3)21-20(29)23-19(25)12-4-7-15-17(8-12)28-10-27-15/h4-9,11H,10H2,1-3H3,(H,22,24)(H2,21,23,25,29)InChIKey
JBHATWLHLRYNRP-UHFFFAOYSA-NSynonyms
871220-04-1871220041
CC(C)C(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC3=C(C=C2)OCO3)OC
InChI=1SC20H21N3O5Sc111(2)18(24)22146513(916(14)263)2120(29)2319(25)12471517(812)28102715h4911H10H213H3(H2224)(H221232529)
MFCD07347997
N((3methoxy4((2methylpropanoyl)amino)phenyl)carbamothioyl)13benzodioxole5carboxamide
N((3METHOXY4(2METHYLPROPANOYLAMINO)PHENYL)CARBAMOTHIOYL)13BENZODIOXOLE5CARBOXAMIDE
N(4((((13BENZODIOXOL5YLCARBONYL)AMINO)CARBOTHIOYL)AMINO)2METHOXYPHENYL)2METHYLPROPANAMIDE
ZINC000006590523
ZINC06590523
ZINC6590523
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