Vitas-M small molecule compound
N-{[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}-4-tert-butylbenzamide
Catalog ID
STK173133
SMILES S=C(Nc1cccc(c1C)c1nc2c(o1)cccc2)NC(=O)c1ccc(cc1)C(C)(C)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 C26H25N3O2S MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S/c1-16-19(24-27-21-9-5-6-11-22(21)31-24)8-7-10-20(16)28-25(32)29-23(30)17-12-14-18(15-13-17)26(2,3)4/h5-15H,1-4H3,(H2,28,29,30,32)InChIKey
UPRYARRYELYMEB-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=NC4=CC=CC=C4O3
InChI=1SC26H25N3O2Sc11619(2427219561122(21)3124)871020(16)2825(32)2923(30)17121418(151317)26(23)4h515H14H3(H228293032)
MFCD02921237
N((3(13BENZOXAZOL2YL)2METHYLPHENYL)CARBAMOTHIOYL)4TERTBUTYLBENZAMIDE
ZINC000002814062
ZINC02814062
ZINC2814062
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