Vitas-M small molecule compound
3-[(3-chlorobenzyl)sulfanyl]-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4-(propan-2-yl)-4H-1,2,4-triazole
Catalog ID
STK491600
SMILES CC1CCc2c(C1)scc2c1nnc(n1C(C)C)SCc1cccc(c1)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 C21H24ClN3S2 MW 418.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3S2/c1-13(2)25-20(18-12-26-19-9-14(3)7-8-17(18)19)23-24-21(25)27-11-15-5-4-6-16(22)10-15/h4-6,10,12-14H,7-9,11H2,1-3H3InChIKey
HYXQTPKBNXPAFL-UHFFFAOYSA-NSynonyms
3((3chlorobenzyl)sulfanyl)5(6methyl4567tetrahydro1benzothiophen3yl)4(propan2yl)4H124triazole
3((3chlorophenyl)methylsulfanyl)5(6methyl4567tetrahydro1benzothiophen3yl)4propan2yl124triazole
CC1CCC2=C(C1)SC=C2C3=NN=C(N3C(C)C)SCC4=CC(=CC=C4)Cl
InChI=1SC21H24ClN3S2c113(2)2520(18122619914(3)7817(18)19)232421(25)27111554616(22)1015h46101214H7911H213H3
MFCD05062665
ZINC000014057016
ZINC000014057019
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