Vitas-M small molecule compound
ethyl 4-[({[5-({[(3,4-dimethoxyphenyl)carbonyl]amino}methyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK114555
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1CC)CNC(=O)c1ccc(c(c1)OC)OC
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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 C25H29N5O6S MW 527.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O6S/c1-5-30-21(14-26-23(32)17-9-12-19(34-3)20(13-17)35-4)28-29-25(30)37-15-22(31)27-18-10-7-16(8-11-18)24(33)36-6-2/h7-13H,5-6,14-15H2,1-4H3,(H,26,32)(H,27,31)InChIKey
IZSVEDCSFJLCHF-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OCC)CNC(=O)C3=CC(=C(C=C3)OC)OC
ETHYL4((((5((((34DIMETHOXYPHENYL)CARBONYL)AMINO)METHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2((5(((34DIMETHOXYBENZOYL)AMINO)METHYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC25H29N5O6Sc153021(142623(32)1791219(343)20(1317)354)282925(30)371522(31)271810716(81118)24(33)3662h713H561415H214H3(H2632)(H2731)
MFCD04127899
ZINC000009305269
ZINC09305269
ZINC9305269
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