Vitas-M small molecule compound
2-{[5-(5-chloro-2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Catalog ID
STL376981
SMILES COc1cccc(c1)NC(=O)CSc1nnc([nH]1)c1cc(Cl)ccc1OC
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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 C18H17ClN4O3S MW 404.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O3S/c1-25-13-5-3-4-12(9-13)20-16(24)10-27-18-21-17(22-23-18)14-8-11(19)6-7-15(14)26-2/h3-9H,10H2,1-2H3,(H,20,24)(H,21,22,23)InChIKey
DOKZQFDGTJYMRL-UHFFFAOYSA-NSynonyms
2((5(5CHLORO2METHOXYPHENYL)1H124TRIAZOL3YL)SULFANYL)N(3METHOXYPHENYL)ACETAMIDE
2((5(5chloro2methoxyphenyl)4H124triazol3yl)sulfanyl)N(3methoxyphenyl)acetamide
COC1=C(C=C(C=C1)Cl)C2=NC(=NN2)SCC(=O)NC3=CC(=CC=C3)OC
COc1cccc(c1)NC(=O)CSc1nnc((nH)1)c1cc(Cl)ccc1OC
InChI=1SC18H17ClN4O3Sc1251353412(913)2016(24)1027182117(222318)14811(19)6715(14)262h39H10H212H3(H2024)(H212223)
MFCD07189061
ZINC000004512900
ZINC04512900
ZINC4512900
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