Vitas-M small molecule compound
3-[(2-chlorobenzyl)sulfanyl]-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Catalog ID
STK465154
SMILES C=CCn1c(SCc2ccccc2Cl)nnc1c1csc2c1CCC(C2)C
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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 C21H22ClN3S2 MW 416.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3S2/c1-3-10-25-20(17-13-26-19-11-14(2)8-9-16(17)19)23-24-21(25)27-12-15-6-4-5-7-18(15)22/h3-7,13-14H,1,8-12H2,2H3InChIKey
UGYZQWBLBRLNDS-UHFFFAOYSA-NSynonyms
3((2chlorobenzyl)sulfanyl)5(6methyl4567tetrahydro1benzothiophen3yl)4(prop2en1yl)4H124triazole
3((2chlorophenyl)methylsulfanyl)5(6methyl4567tetrahydro1benzothiophen3yl)4prop2enyl124triazole
CC1CCC2=C(C1)SC=C2C3=NN=C(N3CC=C)SCC4=CC=CC=C4Cl
InChI=1SC21H22ClN3S2c13102520(171326191114(2)8916(17)19)232421(25)271215645718(15)22h371314H1812H22H3
MFCD06072357
ZINC000017090465
ZINC000017090466
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