Vitas-M small molecule compound

2-{3-methoxy-4-[2-(3-methoxyphenoxy)ethoxy]phenyl}-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STK040441
SMILES COc1cc(ccc1OCCOc1cccc(c1)OC)c1nc2sc3c(c2c(=O)[nH]1)CCC(C3)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 C27H28N2O5S MW 492.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5S/c1-16-7-9-20-23(13-16)35-27-24(20)26(30)28-25(29-27)17-8-10-21(22(14-17)32-3)34-12-11-33-19-6-4-5-18(15-19)31-2/h4-6,8,10,14-16H,7,9,11-13H2,1-3H3,(H,28,29,30)
InChIKey
VPWQETRWSBVHPF-UHFFFAOYSA-N
Synonyms

2(3methoxy4(2(3methoxyphenoxy)ethoxy)phenyl)7methyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(3methoxy4(2(3methoxyphenoxy)ethoxy)phenyl)7methyl5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)NC(=N3)C4=CC(=C(C=C4)OCCOC5=CC=CC(=C5)OC)OC
COc1cc(ccc1OCCOc1cccc(c1)OC)c1nc2sc3c(c2c(=O)(nH)1)CCC(C3)C
InChI=1SC27H28N2O5Sc116792023(1316)352724(20)26(30)2825(2927)1781021(22(1417)323)341211331964518(1519)312h468101416H791113H213H3(H282930)
MFCD03570859
STK040441
ZINC000009425493
ZINC000009425494

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Available files

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