Vitas-M small molecule compound
3-methoxy-5,6,9,10,11,12,13,16-octahydro-8H-cyclohepta[4'',5'']thieno[2'',3'':4',5']pyrimido[1',2':1,2]pyrido[3,4-b]indol-8-one
Catalog ID
STL512903
SMILES COc1ccc2c(c1)c1CCn3c(c1[nH]2)nc1c(c3=O)c2c(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 C22H21N3O2S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O2S/c1-27-12-7-8-16-15(11-12)13-9-10-25-20(19(13)23-16)24-21-18(22(25)26)14-5-3-2-4-6-17(14)28-21/h7-8,11,23H,2-6,9-10H2,1H3InChIKey
JHVGEKQBXPOUBF-UHFFFAOYSA-NSynonyms
356587-19-41208377
20methoxy11thia11316triazahexacyclo(121100^(312)0^(410)0^(1523)0^(1722))pentacosa3(12)4(10)1315(23)17(22)1820heptaen2one
356587194
3methoxy5691011121316octahydro8Hcyclohepta(45)thieno(2345)pyrimido(1212)pyrido(34b)indol8one
3methoxy91011121316hexahydro5Hcyclohepta(45)thieno(2345)pyrimido(1212)pyrido(34b)indol8(6H)one
COc1ccc2c(c1)c1CCn3c(c1(nH)2)nc1c(c3=O)c2c(s1)CCCCC2
InChI=1SC22H21N3O2Sc12712781615(1112)139102520(19(13)2316)242118(22(25)26)145324617(14)2821h781123H26910H21H3
MFCD01241976
ZINC000000978776
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