Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK218380
SMILES N#Cc1c(NC(=O)CSc2nnc(n2c2ccc(cc2)C)c2ccccc2)sc2c1CCCC2
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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 C26H23N5OS2 MW 485.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5OS2/c1-17-11-13-19(14-12-17)31-24(18-7-3-2-4-8-18)29-30-26(31)33-16-23(32)28-25-21(15-27)20-9-5-6-10-22(20)34-25/h2-4,7-8,11-14H,5-6,9-10,16H2,1H3,(H,28,32)InChIKey
LSABJRBYPRFHHK-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N)C5=CC=CC=C5
InChI=1SC26H23N5OS2c117111319(141217)3124(187324818)293026(31)331623(32)282521(1527)209561022(20)3425h24781114H5691016H21H3(H2832)
MFCD04387892
N(3cyano4567tetrahydro1benzothiophen2yl)2((4(4methylphenyl)5phenyl124triazol3yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2((4(4methylphenyl)5phenyl4H124triazol3yl)sulfanyl)acetamide
ZINC000002850836
ZINC02850836
ZINC2850836
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