Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[5-(2-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK134705
SMILES C=CCn1c(SCC(=O)Nc2sc3c(c2C#N)CCCC3)nnc1c1ccccc1C
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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 C23H23N5OS2 MW 449.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5OS2/c1-3-12-28-21(16-9-5-4-8-15(16)2)26-27-23(28)30-14-20(29)25-22-18(13-24)17-10-6-7-11-19(17)31-22/h3-5,8-9H,1,6-7,10-12,14H2,2H3,(H,25,29)InChIKey
DFSPKQPHANYSRM-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1C2=NN=C(N2CC=C)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N
InChI=1SC23H23N5OS2c13122821(16954815(16)2)262723(28)301420(29)252218(1324)1710671119(17)3122h3589H167101214H22H3(H2529)
MFCD05993852
N(3cyano4567tetrahydro1benzothiophen2yl)2((5(2methylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2((5(2methylphenyl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000001123189
ZINC01123189
ZINC1123189
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