Vitas-M small molecule compound

N-(3-carbamoyl-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

Catalog ID
STK375550
SMILES NC(=O)c1c(sc2c1CCCCCC2)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl

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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 C22H21Cl2N3O3S MW 478.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21Cl2N3O3S/c1-11-16(19(27-30-11)18-13(23)8-6-9-14(18)24)21(29)26-22-17(20(25)28)12-7-4-2-3-5-10-15(12)31-22/h6,8-9H,2-5,7,10H2,1H3,(H2,25,28)(H,26,29)
InChIKey
MAYWFZDBXSQOKR-UHFFFAOYSA-N
Synonyms
303137-79-3
303137793
CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC3=C(C4=C(S3)CCCCCC4)C(=O)N
InChI=1SC22H21Cl2N3O3Sc11116(19(273011)1813(23)86914(18)24)21(29)262217(20(25)28)12742351015(12)3122h689H25710H21H3(H22528)(H2629)
MFCD01344436
N(3carbamoyl456789hexahydrocycloocta(b)thiophen2yl)3(26dichlorophenyl)5methyl12oxazole4carboxamide
ZINC000002737475
ZINC02737475
ZINC2737475

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Available files

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