Vitas-M small molecule compound
N-({2-methoxy-5-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}carbamothioyl)-3-(2-methylpropoxy)benzamide
Catalog ID
STK389902
SMILES COc1ccc(cc1NC(=S)NC(=O)c1cccc(c1)OCC(C)C)c1oc2c(n1)cc(cc2)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 C29H31N3O4S MW 517.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O4S/c1-17(2)16-35-22-8-6-7-20(13-22)27(33)32-29(37)31-23-15-21(10-11-25(23)34-5)28-30-24-14-19(18(3)4)9-12-26(24)36-28/h6-15,17-18H,16H2,1-5H3,(H2,31,32,33,37)InChIKey
JZXOFNRLEYWPCC-UHFFFAOYSA-NSynonyms
CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC(=C4)C(C)C)OC
InChI=1SC29H31N3O4Sc117(2)16352286720(1322)27(33)3229(37)31231521(101125(23)345)2830241419(18(3)4)91226(24)3628h6151718H16H215H3(H231323337)
MFCD05661427
N(((2METHOXY5(5(METHYLETHYL)BENZOXAZOL2YL)PHENYL)AMINO)THIOXOMETHYL)(3(2METHYLPROPOXY)PHENYL)CARBOXAMIDE
N((2METHOXY5(5(1METHYLETHYL)13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)3(2METHYLPROPOXY)BENZAMIDE
N((2methoxy5(5(propan2yl)13benzoxazol2yl)phenyl)carbamothioyl)3(2methylpropoxy)benzamide
N((2METHOXY5(5PROPAN2YL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)3(2METHYLPROPOXY)BENZAMIDE
ZINC000004122735
ZINC04122735
ZINC4122735
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.