Vitas-M small molecule compound
N-[3-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)phenyl]-2-methylbenzamide
Catalog ID
STK119422
SMILES O=C(NC1CCCCC1)CSc1nnc(n1C)c1cccc(c1)NC(=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 C25H29N5O2S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O2S/c1-17-9-6-7-14-21(17)24(32)27-20-13-8-10-18(15-20)23-28-29-25(30(23)2)33-16-22(31)26-19-11-4-3-5-12-19/h6-10,13-15,19H,3-5,11-12,16H2,1-2H3,(H,26,31)(H,27,32)InChIKey
JPGYTKDBBMFSLB-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)C3=NN=C(N3C)SCC(=O)NC4CCCCC4
InChI=1SC25H29N5O2Sc1179671421(17)24(32)27201381018(1520)23282925(30(23)2)331622(31)2619114351219h610131519H35111216H212H3(H2631)(H2732)
MFCD03273340
N(3(5((2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PHENYL)2METHYLBENZAMIDE
N(3(5(2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)PHENYL)2METHYLBENZAMIDE
ZINC000009805592
ZINC09805592
ZINC9805592
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