Vitas-M small molecule compound
ethyl 2-(acetylamino)-6-[(4-ethylpiperazin-1-yl)methyl]-7-hydroxy-1-benzothiophene-3-carboxylate
Catalog ID
STK386537
SMILES CCOC(=O)c1c(NC(=O)C)sc2c1ccc(c2O)CN1CCN(CC1)CC
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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 C20H27N3O4S MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O4S/c1-4-22-8-10-23(11-9-22)12-14-6-7-15-16(20(26)27-5-2)19(21-13(3)24)28-18(15)17(14)25/h6-7,25H,4-5,8-12H2,1-3H3,(H,21,24)InChIKey
OWNGXKCAGUZTJJ-UHFFFAOYSA-NSynonyms
2ACETAMIDO6((4ETHYL1PIPERAZINYL)METHYL)7HYDROXY1BENZOTHIOPHENE3CARBOXYLICACIDETHYLESTER
2ACETAMIDO6((4ETHYLPIPERAZINO)METHYL)7HYDROXYBENZOTHIOPHENE3CARBOXYLICACIDETHYLESTER
CCN1CCN(CC1)CC2=C(C3=C(C=C2)C(=C(S3)NC(=O)C)C(=O)OCC)O
ethyl2(acetylamino)6((4ethylpiperazin1yl)methyl)7hydroxy1benzothiophene3carboxylate
ETHYL2ACETAMIDO6((4ETHYLPIPERAZIN1YL)METHYL)7HYDROXY1BENZOTHIOPHENE3CARBOXYLATE
ETHYL2ACETAMIDO6((4ETHYLPIPERAZIN1YL)METHYL)7OXIDANYL1BENZOTHIOPHENE3CARBOXYLATE
InChI=1SC20H27N3O4Sc142281023(11922)1214671516(20(26)2752)19(2113(3)24)2818(15)17(14)25h6725H45812H213H3(H2124)
MFCD00731219
ZINC000022035479
ZINC22035479
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