Vitas-M small molecule compound

ethyl 1-(4-chlorobenzyl)-3,5-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxylate

Catalog ID
STK610415
SMILES CCOC(=O)c1sc2c(c1C)c(=O)n(c(=O)n2Cc1ccc(cc1)Cl)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 C18H17ClN2O4S MW 392.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN2O4S/c1-4-25-17(23)14-10(2)13-15(22)20(3)18(24)21(16(13)26-14)9-11-5-7-12(19)8-6-11/h5-8H,4,9H2,1-3H3
InChIKey
QCLTXLNFCUQPRG-UHFFFAOYSA-N
Synonyms
898631-62-4
898631624
CCOC(=O)C1=C(C2=C(S1)N(C(=O)N(C2=O)C)CC3=CC=C(C=C3)Cl)C
ETHYL1((4CHLOROPHENYL)METHYL)35DIMETHYL24DIOXOTHIENO(23D)PYRIMIDINE6CARBOXYLATE
ethyl1(4chlorobenzyl)35dimethyl24dioxo1234tetrahydrothieno(23d)pyrimidine6carboxylate
InChI=1SC18H17ClN2O4Sc142517(23)1410(2)1315(22)20(3)18(24)21(16(13)2614)9115712(19)8611h58H49H213H3
MFCD08291926
ZINC000006760370
ZINC06760370
ZINC6760370

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Available files

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