Vitas-M small molecule compound
N-{[5-({2-[(2-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-3,4-dimethoxybenzamide
Catalog ID
STK115411
SMILES COc1cc(ccc1OC)C(=O)NCc1nnc(n1C)SCC(=O)Nc1ccccc1CC
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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 C23H27N5O4S MW 469.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O4S/c1-5-15-8-6-7-9-17(15)25-21(29)14-33-23-27-26-20(28(23)2)13-24-22(30)16-10-11-18(31-3)19(12-16)32-4/h6-12H,5,13-14H2,1-4H3,(H,24,30)(H,25,29)InChIKey
VNWBCOJESSNMJK-UHFFFAOYSA-NSynonyms
CCC1=CC=CC=C1NC(=O)CSC2=NN=C(N2C)CNC(=O)C3=CC(=C(C=C3)OC)OC
InChI=1SC23H27N5O4Sc1515867917(15)2521(29)143323272620(28(23)2)132422(30)16101118(313)19(1216)324h612H51314H214H3(H2430)(H2529)
MFCD04128150
N((5((2((2ETHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
N((5((2(2ETHYLANILINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
N((5(2(2ETHYLANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
ZINC000000687494
ZINC00687494
ZINC687494
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