Vitas-M small molecule compound

3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(thiophen-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione

Catalog ID
STK714962
SMILES COc1ccc(cc1OC)CCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1cccs1

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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 C25H20N2O5S MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O5S/c1-30-18-10-9-15(14-19(18)31-2)11-12-27-23(20-8-5-13-33-20)26-24-21(25(27)29)22(28)16-6-3-4-7-17(16)32-24/h3-10,13-14H,11-12H2,1-2H3
InChIKey
RTZFXGMJCDZFAM-UHFFFAOYSA-N
Synonyms
883953-05-7
3(2(34dimethoxyphenyl)ethyl)2(thiophen2yl)4Hchromeno(23d)pyrimidine45(3H)dione
3(2(34DIMETHOXYPHENYL)ETHYL)2THIOPHEN2YLCHROMENO(23D)PYRIMIDINE45DIONE
3(34dimethoxyphenethyl)2(thiophen2yl)3Hchromeno(23d)pyrimidine45dione
883953057
COC1=C(C=C(C=C1)CCN2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4O3)C5=CC=CS5)OC
InChI=1SC25H20N2O5Sc1301810915(1419(18)312)11122723(2085133320)262421(25(27)29)22(28)16634717(16)3224h3101314H1112H212H3
MFCD06601395
ZINC000002228469
ZINC02228469
ZINC2228469

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Available files

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