Vitas-M small molecule compound
4-(butan-2-yloxy)-N-{[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
Catalog ID
STK174099
SMILES CCC(Oc1ccc(cc1)C(=O)NC(=S)Nc1cccc(c1C)c1nc2c(o1)ccc(c2)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 C27H27N3O3S MW 473.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O3S/c1-5-17(3)32-20-12-10-19(11-13-20)25(31)30-27(34)29-22-8-6-7-21(18(22)4)26-28-23-15-16(2)9-14-24(23)33-26/h6-15,17H,5H2,1-4H3,(H2,29,30,31,34)InChIKey
ZAQDHOGRDOKWMY-UHFFFAOYSA-NSynonyms
4(BUTAN2YLOXY)N((2METHYL3(5METHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
4BUTAN2YLOXYN((2METHYL3(5METHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2C)C3=NC4=C(O3)C=CC(=C4)C
InChI=1SC27H27N3O3Sc1517(3)3220121019(111320)25(31)3027(34)292286721(18(22)4)2628231516(2)91424(23)3326h61517H5H214H3(H229303134)
MFCD03574559
ZINC000009892119
ZINC000009892120
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