Vitas-M small molecule compound
propan-2-yl 2-{[phenyl(phenylsulfanyl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK426623
SMILES CC(OC(=O)c1c(NC(=O)C(c2ccccc2)Sc2ccccc2)sc2c1CCCCC2)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 C27H29NO3S2 MW 479.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO3S2/c1-18(2)31-27(30)23-21-16-10-5-11-17-22(21)33-26(23)28-25(29)24(19-12-6-3-7-13-19)32-20-14-8-4-9-15-20/h3-4,6-9,12-15,18,24H,5,10-11,16-17H2,1-2H3,(H,28,29)InChIKey
JVDUFHORDYRKTD-UHFFFAOYSA-NSynonyms
CC(C)OC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4
InChI=1SC27H29NO3S2c118(2)3127(30)232116105111722(21)3326(23)2825(29)24(19126371319)3220148491520h346912151824H510111617H212H3(H2829)
MFCD01349688
propan2yl2((2phenyl2phenylsulfanylacetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
propan2yl2((phenyl(phenylsulfanyl)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ZINC000002739073
ZINC000002739074
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