Vitas-M small molecule compound
5-(2-chlorophenyl)-2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK663560
SMILES Clc1ccccc1c1nn(c(=S)n1C)CN1CCC2(CC1)OCCO2
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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 C17H21ClN4O2S MW 380.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21ClN4O2S/c1-20-15(13-4-2-3-5-14(13)18)19-22(16(20)25)12-21-8-6-17(7-9-21)23-10-11-24-17/h2-5H,6-12H2,1H3InChIKey
FOZPCMCUWMMSCE-UHFFFAOYSA-NSynonyms
298686-84-71H124TRIAZOLE5(4H)THIONE3(2CHLOROPHENYL)4METHYL1(148DIOXAZASPIRO(45)DEC8YL)METHYL
298686847
5(2chlorophenyl)2(14dioxa8azaspiro(45)dec8ylmethyl)4methyl24dihydro3H124triazole3thione
5(2CHLOROPHENYL)2(14DIOXA8AZASPIRO(45)DECAN8YLMETHYL)4METHYL124TRIAZOLE3THIONE
CN1C(=NN(C1=S)CN2CCC3(CC2)OCCO3)C4=CC=CC=C4Cl
InChI=1SC17H21ClN4O2Sc12015(13423514(13)18)1922(16(20)25)12218617(7921)2310112417h25H612H21H3
MFCD01809856
ZINC000004536518
ZINC4536518
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