Vitas-M small molecule compound
4-[(4-chlorobenzyl)oxy]-N-{[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-3-methoxybenzamide
Catalog ID
STK236193
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccccc1Cl
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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 C29H21Cl2N3O4S MW 578.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21Cl2N3O4S/c1-36-26-14-18(8-12-25(26)37-16-17-6-9-19(30)10-7-17)27(35)34-29(39)32-20-11-13-24-23(15-20)33-28(38-24)21-4-2-3-5-22(21)31/h2-15H,16H2,1H3,(H2,32,34,35,39)InChIKey
HPRCLXYGHIXHPL-UHFFFAOYSA-NSynonyms
4((4CHLOROBENZYL)OXY)N((2(2CHLOROPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)3METHOXYBENZAMIDE
COC1=C(C=CC(=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4Cl)OCC5=CC=C(C=C5)Cl
InChI=1SC29H21Cl2N3O4Sc136261418(81225(26)3716176919(30)10717)27(35)3429(39)322011132423(1520)3328(3824)21423522(21)31h215H16H21H3(H232343539)
MFCD03909513
N((2(2CHLOROPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)4((4CHLOROPHENYL)METHOXY)3METHOXYBENZAMIDE
ZINC000006289358
ZINC6289358
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