Vitas-M small molecule compound
N-{[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK021783
SMILES COc1ccc(cc1Cl)c1oc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccccc1
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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 C22H16ClN3O3S MW 437.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O3S/c1-28-18-9-7-14(11-16(18)23)21-25-17-12-15(8-10-19(17)29-21)24-22(30)26-20(27)13-5-3-2-4-6-13/h2-12H,1H3,(H2,24,26,27,30)InChIKey
OWMOOGWCMYBEOI-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=CC=C4)Cl
COc1ccc(cc1Cl)c1oc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccccc1
InChI=1SC22H16ClN3O3Sc128189714(1116(18)23)2125171215(81019(17)2921)2422(30)2620(27)135324613h212H1H3(H224262730)
MFCD02803522
N((2(3CHLORO4METHOXYPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
STK021783
ZINC000001185918
ZINC01185918
ZINC1185918
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