Vitas-M small molecule compound
2-{[2-(3-chlorophenoxy)propanoyl]amino}-N-(2-ethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Catalog ID
STK059263
SMILES CCOc1ccccc1NC(=O)c1c(NC(=O)C(Oc2cccc(c2)Cl)C)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 C27H29ClN2O4S MW 513.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29ClN2O4S/c1-3-33-22-14-8-7-13-21(22)29-26(32)24-20-12-5-4-6-15-23(20)35-27(24)30-25(31)17(2)34-19-11-9-10-18(28)16-19/h7-11,13-14,16-17H,3-6,12,15H2,1-2H3,(H,29,32)(H,30,31)InChIKey
CDAZPWMJILNPGM-UHFFFAOYSA-NSynonyms
2((2(3chlorophenoxy)propanoyl)amino)N(2ethoxyphenyl)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
2(2(3chlorophenoxy)propanoylamino)N(2ethoxyphenyl)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
CCOC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCCC3)NC(=O)C(C)OC4=CC(=CC=C4)Cl
CCOc1ccccc1NC(=O)c1c(NC(=O)C(Oc2cccc(c2)Cl)C)sc2c1CCCCC2
InChI=1SC27H29ClN2O4Sc13332214871321(22)2926(32)2420125461523(20)3527(24)3025(31)17(2)34191191018(28)1619h71113141617H361215H212H3(H2932)(H3031)
MFCD01825051
STK059263
ZINC000008589773
ZINC000008589774
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