Vitas-M small molecule compound

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

Catalog ID
STK236799
SMILES O=C(NC(=S)Nc1ccc2c(c1)nc(o2)c1cc(I)ccc1Cl)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 C25H21ClIN3O3S MW 605.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClIN3O3S/c1-14(2)15-3-7-18(8-4-15)32-13-23(31)30-25(34)28-17-6-10-22-21(12-17)29-24(33-22)19-11-16(27)5-9-20(19)26/h3-12,14H,13H2,1-2H3,(H2,28,30,31,34)
InChIKey
LQOIYFIZVHCEKC-UHFFFAOYSA-N
Synonyms

CC(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Cl
InChI=1SC25H21ClIN3O3Sc114(2)153718(8415)321323(31)3025(34)28176102221(1217)2924(3322)191116(27)5920(19)26h31214H13H212H3(H228303134)
MFCD03698212
N((2(2chloro5iodophenyl)13benzoxazol5yl)carbamothioyl)2(4(propan2yl)phenoxy)acetamide
N((2(2CHLORO5IODOPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)2(4PROPAN2YLPHENOXY)ACETAMIDE
N(2(2CHLORO5IODOPHENYL)13BENZOXAZOL5YL)N((4ISOPROPYLPHENOXY)ACETYL)THIOUREA
ZINC000008443424
ZINC08443424
ZINC8443424

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Available files

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