Vitas-M small molecule compound
N-{[5-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-2-methylbenzamide
Catalog ID
STK140711
SMILES CCOc1ccc(cc1)NC(=O)CSc1nnc(n1CC)CNC(=O)c1ccccc1C
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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 C23H27N5O3S MW 453.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O3S/c1-4-28-20(14-24-22(30)19-9-7-6-8-16(19)3)26-27-23(28)32-15-21(29)25-17-10-12-18(13-11-17)31-5-2/h6-13H,4-5,14-15H2,1-3H3,(H,24,30)(H,25,29)InChIKey
AQISLPHMENGZQM-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)OCC)CNC(=O)C3=CC=CC=C3C
InChI=1SC23H27N5O3Sc142820(142422(30)19976816(19)3)262723(28)321521(29)2517101218(131117)3152h613H451415H213H3(H2430)(H2529)
MFCD08676542
N((5((2((4ETHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)METHYL)2METHYLBENZAMIDE
N((5(2(4ETHOXYANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)METHYL)2METHYLBENZAMIDE
ZINC000009601253
ZINC09601253
ZINC9601253
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