Vitas-M small molecule compound
[2-oxo-2-({3-[(pyridin-3-ylmethyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl}amino)ethoxy]acetic acid
Catalog ID
STK471748
SMILES OC(=O)COCC(=O)Nc1sc2c(c1C(=O)NCc1cccnc1)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 C20H23N3O5S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O5S/c24-16(11-28-12-17(25)26)23-20-18(14-6-2-1-3-7-15(14)29-20)19(27)22-10-13-5-4-8-21-9-13/h4-5,8-9H,1-3,6-7,10-12H2,(H,22,27)(H,23,24)(H,25,26)InChIKey
VKLIODAIHDACSI-UHFFFAOYSA-NSynonyms
(2oxo2((3((pyridin3ylmethyl)carbamoyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)amino)ethoxy)aceticacid
2(2oxo2((3(pyridin3ylmethylcarbamoyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)amino)ethoxy)aceticacid
C1CCC2=C(CC1)SC(=C2C(=O)NCC3=CN=CC=C3)NC(=O)COCC(=O)O
InChI=1SC20H23N3O5Sc2416(11281217(25)26)232018(146213715(14)2920)19(27)22101354821913h4589H13671012H2(H2227)(H2324)(H2526)
MFCD06079669
ZINC000017091064
ZINC17091064
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