Vitas-M small molecule compound
5-[3-chloro-5-methoxy-4-(naphthalen-2-ylmethoxy)benzylidene]-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188154
SMILES COc1cc(C=C2C(=O)N(C)C(=S)N(C2=O)C)cc(c1OCc1ccc2c(c1)cccc2)Cl
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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 C25H21ClN2O4S MW 480.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O4S/c1-27-23(29)19(24(30)28(2)25(27)33)11-16-12-20(26)22(21(13-16)31-3)32-14-15-8-9-17-6-4-5-7-18(17)10-15/h4-13H,14H2,1-3H3InChIKey
TZSDPEPCFKOEOI-UHFFFAOYSA-NSynonyms
5((3CHLORO5METHOXY4(NAPHTHALEN2YLMETHOXY)PHENYL)METHYLIDENE)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
5(3CHLORO5METHOXY4(2NAPHTHYLMETHOXY)BENZYLIDENE)13DIMETHYL2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
5(3CHLORO5METHOXY4(NAPHTHALEN2YLMETHOXY)BENZYLIDENE)13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC3=CC4=CC=CC=C4C=C3)OC)C(=O)N(C1=S)C
InChI=1SC25H21ClN2O4Sc12723(29)19(24(30)28(2)25(27)33)11161220(26)22(21(1316)313)3214158917645718(17)1015h413H14H213H3
MFCD02779654
ZINC000000631983
ZINC00631983
ZINC631983
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