Vitas-M small molecule compound
4-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one
Catalog ID
STK693154
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)C1CC(=O)Nc2c1c1CCCCc1s2
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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 C25H24ClNO3S MW 453.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClNO3S/c1-29-21-12-16(8-11-20(21)30-14-15-6-9-17(26)10-7-15)19-13-23(28)27-25-24(19)18-4-2-3-5-22(18)31-25/h6-12,19H,2-5,13-14H2,1H3,(H,27,28)InChIKey
LEUFZPZZXPCXCN-UHFFFAOYSA-NSynonyms
4(4((4chlorobenzyl)oxy)3methoxyphenyl)345678hexahydro(1)benzothieno(23b)pyridin2(1H)one
4(4((4chlorophenyl)methoxy)3methoxyphenyl)345678hexahydro1H(1)benzothiolo(23b)pyridin2one
COC1=C(C=CC(=C1)C2CC(=O)NC3=C2C4=C(S3)CCCC4)OCC5=CC=C(C=C5)Cl
InChI=1SC25H24ClNO3Sc129211216(81120(21)3014156917(26)10715)191323(28)272524(19)18423522(18)3125h61219H251314H21H3(H2728)
MFCD10039228
ZINC000015085997
ZINC000015085999
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