Vitas-M small molecule compound
[1-(2,4-dichlorobenzyl)-2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl]acetic acid
Catalog ID
STK616028
SMILES Clc1ccc(c(c1)Cl)Cn1c(=O)n(CC(=O)O)c(=O)c2c1sc1c2CCCC1
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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 C19H16Cl2N2O4S MW 439.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16Cl2N2O4S/c20-11-6-5-10(13(21)7-11)8-23-18-16(12-3-1-2-4-14(12)28-18)17(26)22(19(23)27)9-15(24)25/h5-7H,1-4,8-9H2,(H,24,25)InChIKey
ACQMQUVREUWIBZ-UHFFFAOYSA-NSynonyms
132221-13-7(1(24dichlorobenzyl)24dioxo145678hexahydro(1)benzothieno(23d)pyrimidin3(2H)yl)aceticacid
132221137
2(1((24dichlorophenyl)methyl)24dioxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)aceticacid
2(1(24dichlorobenzyl)24dioxo125678hexahydrobenzo(45)thieno(23d)pyrimidin3(4H)yl)aceticacid
C1CCC2=C(C1)C3=C(S2)N(C(=O)N(C3=O)CC(=O)O)CC4=C(C=C(C=C4)Cl)Cl
InChI=1SC19H16Cl2N2O4Sc20116510(13(21)711)8231816(12312414(12)2818)17(26)22(19(23)27)915(24)25h57H1489H2(H2425)
MFCD08292921
ZINC000013610002
ZINC13610002
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