Vitas-M small molecule compound
methyl 4-chloro-2-{[(2,4-dioxo-3-propyl-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl)acetyl]amino}benzoate
Catalog ID
STL073701
SMILES CCCn1c(=O)n(CC(=O)Nc2cc(Cl)ccc2C(=O)OC)c2c(c1=O)scc2
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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 C19H18ClN3O5S MW 435.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O5S/c1-3-7-22-17(25)16-14(6-8-29-16)23(19(22)27)10-15(24)21-13-9-11(20)4-5-12(13)18(26)28-2/h4-6,8-9H,3,7,10H2,1-2H3,(H,21,24)InChIKey
JRIHEVHASSYJEB-UHFFFAOYSA-NSynonyms
CCCN1C(=O)C2=C(C=CS2)N(C1=O)CC(=O)NC3=C(C=CC(=C3)Cl)C(=O)OC
InChI=1SC19H18ClN3O5Sc1372217(25)1614(682916)23(19(22)27)1015(24)2113911(20)4512(13)18(26)282h4689H3710H212H3(H2124)
methyl4chloro2(((24dioxo3propyl34dihydrothieno(32d)pyrimidin1(2H)yl)acetyl)amino)benzoate
methyl4chloro2((2(24dioxo3propylthieno(32d)pyrimidin1yl)acetyl)amino)benzoate
MFCD18195145
ZINC000057485897
ZINC57485897
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