Vitas-M small molecule compound

N-{[3-(5,7-dichloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-[4-(propan-2-yl)phenoxy]acetamide

Catalog ID
STK259416
SMILES O=C(NC(=S)Nc1cccc(c1)c1nc2c(o1)c(Cl)cc(c2)Cl)COc1ccc(cc1)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 C25H21Cl2N3O3S MW 514.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21Cl2N3O3S/c1-14(2)15-6-8-19(9-7-15)32-13-22(31)30-25(34)28-18-5-3-4-16(10-18)24-29-21-12-17(26)11-20(27)23(21)33-24/h3-12,14H,13H2,1-2H3,(H2,28,30,31,34)
InChIKey
DFKRDXONFRGUMH-UHFFFAOYSA-N
Synonyms

CC(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=CC(=CC(=C4O3)Cl)Cl
InChI=1SC25H21Cl2N3O3Sc114(2)156819(9715)321322(31)3025(34)281853416(1018)2429211217(26)1120(27)23(21)3324h31214H13H212H3(H228303134)
MFCD03698131
N((3(57dichloro13benzoxazol2yl)phenyl)carbamothioyl)2(4(propan2yl)phenoxy)acetamide
N((3(57DICHLORO13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)2(4PROPAN2YLPHENOXY)ACETAMIDE
N(3(57DICHLORO13BENZOXAZOL2YL)PHENYL)N((4ISOPROPYLPHENOXY)ACETYL)THIOUREA
ZINC000002145247
ZINC02145247
ZINC2145247

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.