Vitas-M small molecule compound
azepan-1-yl[6-(4-chlorophenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]methanone
Catalog ID
STL381345
SMILES Clc1ccc(cc1)C1Nn2c(SC1C(=O)N1CCCCCC1)nnc2C
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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 C18H22ClN5OS MW 391.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22ClN5OS/c1-12-20-21-18-24(12)22-15(13-6-8-14(19)9-7-13)16(26-18)17(25)23-10-4-2-3-5-11-23/h6-9,15-16,22H,2-5,10-11H2,1H3InChIKey
HULVCQBMBCYTOK-UHFFFAOYSA-NSynonyms
azepan1yl(6(4chlorophenyl)3methyl67dihydro5H(124)triazolo(34b)(134)thiadiazin7yl)methanone
CC1=NN=C2N1NC(C(S2)C(=O)N3CCCCCC3)C4=CC=C(C=C4)Cl
InChI=1SC18H22ClN5OSc11220211824(12)2215(136814(19)9713)16(2618)17(25)231042351123h69151622H251011H21H3
MFCD07433402
ZINC000020060423
ZINC000020060429
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