Vitas-M small molecule compound
5-[2-(4-chlorophenyl)cyclopropyl]-4-(3-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK302694
SMILES COc1cccc(c1)n1c(S)nnc1C1CC1c1ccc(cc1)Cl
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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 C18H16ClN3OS MW 357.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN3OS/c1-23-14-4-2-3-13(9-14)22-17(20-21-18(22)24)16-10-15(16)11-5-7-12(19)8-6-11/h2-9,15-16H,10H2,1H3,(H,21,24)InChIKey
HYWPIDHLCBKOFI-UHFFFAOYSA-NSynonyms
680586-77-03(2(4CHLOROPHENYL)CYCLOPROPYL)4(3METHOXYPHENYL)1H124TRIAZOLE5THIONE
5(2(4chlorophenyl)cyclopropyl)4(3methoxyphenyl)4H124triazole3thiol
680586770
COC1=CC=CC(=C1)N2C(=NNC2=S)C3CC3C4=CC=C(C=C4)Cl
InChI=1SC18H16ClN3OSc1231442313(914)2217(202118(22)24)161015(16)115712(19)8611h291516H10H21H3(H2124)
MFCD04048198
ZINC000005423629
ZINC000005423648
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