Vitas-M small molecule compound
5-({1-[2-(2,5-dimethylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL368189
SMILES Cc1ccc(c(c1)OCCn1cc(c2c1cccc2)C=C1C(=O)N(C)C(=S)N(C1=O)C)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 C25H25N3O3S MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3S/c1-16-9-10-17(2)22(13-16)31-12-11-28-15-18(19-7-5-6-8-21(19)28)14-20-23(29)26(3)25(32)27(4)24(20)30/h5-10,13-15H,11-12H2,1-4H3InChIKey
AJKCEBMYKYMYIH-UHFFFAOYSA-NSynonyms
5((1(2(25DIMETHYLPHENOXY)ETHYL)1HINDOL3YL)METHYLENE)13DIMETHYL2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
5((1(2(25dimethylphenoxy)ethyl)1Hindol3yl)methylidene)13dimethyl2thioxodihydropyrimidine46(1H5H)dione
5((1(2(25DIMETHYLPHENOXY)ETHYL)INDOL3YL)METHYLIDENE)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(C=C1)C)OCCN2C=C(C3=CC=CC=C32)C=C4C(=O)N(C(=S)N(C4=O)C)C
InChI=1SC25H25N3O3Sc11691017(2)22(1316)311211281518(19756821(19)28)142023(29)26(3)25(32)27(4)24(20)30h5101315H1112H214H3
MFCD04150660
ZINC000000666865
ZINC00666865
ZINC666865
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