Vitas-M small molecule compound
ethyl 2-({[2-(4-chlorophenyl)cyclopropyl]carbonyl}amino)-5,6,7,8,9,10,11,12,13,14-decahydro-4H-cyclotrideca[b]thiophene-3-carboxylate
Catalog ID
STK450029
SMILES CCOC(=O)c1c(NC(=O)C2CC2c2ccc(cc2)Cl)sc2c1CCCCCCCCCCC2
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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 C28H36ClNO3S MW 502.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36ClNO3S/c1-2-33-28(32)25-21-12-10-8-6-4-3-5-7-9-11-13-24(21)34-27(25)30-26(31)23-18-22(23)19-14-16-20(29)17-15-19/h14-17,22-23H,2-13,18H2,1H3,(H,30,31)InChIKey
SRUPYYRLDDSRMM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCCCCCCCC2)NC(=O)C3CC3C4=CC=C(C=C4)Cl
ethyl15((2(4chlorophenyl)cyclopropanecarbonyl)amino)14thiabicyclo(1130)hexadeca1(13)15diene16carboxylate
ethyl2(((2(4chlorophenyl)cyclopropyl)carbonyl)amino)567891011121314decahydro4Hcyclotrideca(b)thiophene3carboxylate
InChI=1SC28H36ClNO3Sc123328(32)252112108643579111324(21)3427(25)3026(31)231822(23)19141620(29)171519h14172223H21318H21H3(H3031)
MFCD03468538
ZINC000008455253
ZINC000008455256
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