Vitas-M small molecule compound
ethyl 2-({[(4,6-diphenylpyrimidin-2-yl)sulfanyl]acetyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STL503363
SMILES CCOC(=O)c1c(NC(=O)CSc2nc(cc(n2)c2ccccc2)c2ccccc2)sc2c1CCCCC2
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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 C30H29N3O3S2 MW 543.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O3S2/c1-2-36-29(35)27-22-16-10-5-11-17-25(22)38-28(27)33-26(34)19-37-30-31-23(20-12-6-3-7-13-20)18-24(32-30)21-14-8-4-9-15-21/h3-4,6-9,12-15,18H,2,5,10-11,16-17,19H2,1H3,(H,33,34)InChIKey
MDZQXCFTGWVAQL-UHFFFAOYSA-NSynonyms
4325720
ethyl2((((46diphenylpyrimidin2yl)sulfanyl)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((2(46diphenylpyrimidin2yl)sulfanylacetyl)amino)5678tetrahydro4~(H)cyclohepta(b)thiophene3carboxylate
InChI=1SC30H29N3O3S2c123629(35)272216105111725(22)3828(27)3326(34)1937303123(20126371320)1824(3230)21148491521h3469121518H251011161719H21H3(H3334)
MFCD01891271
ZINC000103616793
ZINC103616793
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