Vitas-M small molecule compound
1,3-dimethyl-5-({1-[3-(2-methylphenoxy)propyl]-1H-indol-3-yl}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL417390
SMILES S=C1N(C)C(=O)C(=Cc2cn(c3c2cccc3)CCCOc2ccccc2C)C(=O)N1C
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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/c1-17-9-4-7-12-22(17)31-14-8-13-28-16-18(19-10-5-6-11-21(19)28)15-20-23(29)26(2)25(32)27(3)24(20)30/h4-7,9-12,15-16H,8,13-14H2,1-3H3InChIKey
KOALNUURQKIWKU-UHFFFAOYSA-NSynonyms
13dimethyl5((1(3(2methylphenoxy)propyl)1Hindol3yl)methylidene)2thioxodihydropyrimidine46(1H5H)dione
13dimethyl5((1(3(2methylphenoxy)propyl)indol3yl)methylidene)2sulfanylidene13diazinane46dione
CC1=CC=CC=C1OCCCN2C=C(C3=CC=CC=C32)C=C4C(=O)N(C(=S)N(C4=O)C)C
InChI=1SC25H25N3O3Sc1179471222(17)3114813281618(1910561121(19)28)152023(29)26(2)25(32)27(3)24(20)30h479121516H81314H213H3
MFCD03928657
ZINC000059109584
ZINC59109584
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