Vitas-M small molecule compound
N-(7-methyl-4-oxo-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide
Catalog ID
STK438762
SMILES CC1CCc2c(C1)sc1c2c(=O)n(c(n1)S)NC(=O)c1cc2c(s1)CCCCC2
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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 C21H23N3O2S3 MW 445.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O2S3/c1-11-7-8-13-15(9-11)29-19-17(13)20(26)24(21(27)22-19)23-18(25)16-10-12-5-3-2-4-6-14(12)28-16/h10-11H,2-9H2,1H3,(H,22,27)(H,23,25)InChIKey
ADMXNVRNWAWYFR-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=S)N3)NC(=O)C4=CC5=C(S4)CCCCC5
InChI=1SC21H23N3O2S3c111781315(911)291917(13)20(26)24(21(27)2219)2318(25)1610125324614(12)2816h1011H29H21H3(H2227)(H2325)
MFCD03945385
N(7methyl4oxo2sulfanyl5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)5678tetrahydro4Hcyclohepta(b)thiophene2carboxamide
N(7methyl4oxo2sulfanylidene5678tetrahydro1H(1)benzothiolo(23d)pyrimidin3yl)5678tetrahydro4Hcyclohepta(b)thiophene2carboxamide
ZINC000019643993
ZINC000019643995
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