Vitas-M small molecule compound
2,2-dimethyl-N-{[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}propanamide
Catalog ID
STK067103
SMILES S=C(NC(=O)C(C)(C)C)Nc1cccc(c1C)c1oc2c(n1)cc(cc2)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 C21H23N3O2S MW 381.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O2S/c1-12-9-10-17-16(11-12)22-18(26-17)14-7-6-8-15(13(14)2)23-20(27)24-19(25)21(3,4)5/h6-11H,1-5H3,(H2,23,24,25,27)InChIKey
HYQRJIWDJAKALB-UHFFFAOYSA-NSynonyms
1(22DIMETHYLPROPIONYL)3(2METHYL3(5METHYLBENZOOXAZOL2YL)PHENYL)THIOUREA
22DIMETHYLN((2METHYL3(5METHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)PROPANAMIDE
CC1=CC2=C(C=C1)OC(=N2)C3=C(C(=CC=C3)NC(=S)NC(=O)C(C)(C)C)C
InChI=1SC21H23N3O2Sc1129101716(1112)2218(2617)1476815(13(14)2)2320(27)2419(25)21(34)5h611H15H3(H223242527)
MFCD03568980
S=C(NC(=O)C(C)(C)C)Nc1cccc(c1C)c1oc2c(n1)cc(cc2)C
STK067103
ZINC000001123312
ZINC01123312
ZINC1123312
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