Vitas-M small molecule compound
ethyl 2-[({[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK124309
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc3c(n2)n(CC=C)c2c3cccc2)sc2c1CCC2
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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 C24H23N5O3S2 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O3S2/c1-3-12-29-16-10-6-5-8-14(16)20-21(29)26-24(28-27-20)33-13-18(30)25-22-19(23(31)32-4-2)15-9-7-11-17(15)34-22/h3,5-6,8,10H,1,4,7,9,11-13H2,2H3,(H,25,30)InChIKey
CXZBRVYBRJXKAU-UHFFFAOYSA-NSynonyms
330555-42-5330555425
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=NC4=C(C5=CC=CC=C5N4CC=C)N=N3
ETHYL2((((5(PROP2EN1YL)5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ETHYL2((((5ALLYL5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ETHYL2((2((5PROP2ENYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
InChI=1SC24H23N5O3S2c131229161065814(16)2021(29)2624(282720)331318(30)252219(23(31)3242)15971117(15)3422h356810H14791113H22H3(H2530)
MFCD01821581
ZINC000002186109
ZINC02186109
ZINC2186109
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.