Vitas-M small molecule compound

1,3-dimethyl-5-({1-[3-(4-methylphenoxy)propyl]-1H-indol-3-yl}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STL417394
SMILES Cc1ccc(cc1)OCCCn1cc(c2c1cccc2)C=C1C(=O)N(C)C(=S)N(C1=O)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/c1-17-9-11-19(12-10-17)31-14-6-13-28-16-18(20-7-4-5-8-22(20)28)15-21-23(29)26(2)25(32)27(3)24(21)30/h4-5,7-12,15-16H,6,13-14H2,1-3H3
InChIKey
HMWWPPNKLHWQOP-UHFFFAOYSA-N
Synonyms

13dimethyl5((1(3(4methylphenoxy)propyl)1Hindol3yl)methylidene)2thioxodihydropyrimidine46(1H5H)dione
13dimethyl5((1(3(4methylphenoxy)propyl)indol3yl)methylidene)2sulfanylidene13diazinane46dione
CC1=CC=C(C=C1)OCCCN2C=C(C3=CC=CC=C32)C=C4C(=O)N(C(=S)N(C4=O)C)C
InChI=1SC25H25N3O3Sc11791119(121017)3114613281618(20745822(20)28)152123(29)26(2)25(32)27(3)24(21)30h457121516H61314H213H3
MFCD03928658
ZINC000059109585
ZINC59109585

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Available files

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