Vitas-M small molecule compound

4-{2-[(3-chloro-6-methoxy-1-benzothiophen-2-yl)carbonyl]hydrazinyl}-N-(4-ethoxyphenyl)-4-oxobutanamide

Catalog ID
STK059175
SMILES CCOc1ccc(cc1)NC(=O)CCC(=O)NNC(=O)c1sc2c(c1Cl)ccc(c2)OC

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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 C22H22ClN3O5S MW 475.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O5S/c1-3-31-14-6-4-13(5-7-14)24-18(27)10-11-19(28)25-26-22(29)21-20(23)16-9-8-15(30-2)12-17(16)32-21/h4-9,12H,3,10-11H2,1-2H3,(H,24,27)(H,25,28)(H,26,29)
InChIKey
MSOWXLTVDFQPHI-UHFFFAOYSA-N
Synonyms

4(2((3CHLORO6METHOXY1BENZOTHIOPHEN2YL)CARBONYL)HYDRAZINO)N(4ETHOXYPHENYL)4OXOBUTANAMIDE
4(2((3CHLORO6METHOXY1BENZOTHIOPHEN2YL)CARBONYL)HYDRAZINYL)N(4ETHOXYPHENYL)4OXOBUTANAMIDE
4(2(3CHLORO6METHOXY1BENZOTHIOPHENE2CARBONYL)HYDRAZINYL)N(4ETHOXYPHENYL)4OXOBUTANAMIDE
CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl
CCOc1ccc(cc1)NC(=O)CCC(=O)NNC(=O)c1sc2c(c1Cl)ccc(c2)OC
InChI=1SC22H22ClN3O5Sc1331146413(5714)2418(27)101119(28)252622(29)2120(23)169815(302)1217(16)3221h4912H31011H212H3(H2427)(H2528)(H2629)
MFCD03168614
N((3CHLORO6METHOXYBENZO(B)THIOPHEN2YL)CARBONYLAMINO)N(4ETHOXYPHENYL)BUTANE14DIAMIDE
STK059175
ZINC000009553390
ZINC09553390
ZINC9553390

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Available files

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