Vitas-M small molecule compound

N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[5-methyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK343854
SMILES C=CCn1c(SCC(=O)Nc2sc3c(c2C#N)CCCC3)nnc1C

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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 C17H19N5OS2 MW 373.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5OS2/c1-3-8-22-11(2)20-21-17(22)24-10-15(23)19-16-13(9-18)12-6-4-5-7-14(12)25-16/h3H,1,4-8,10H2,2H3,(H,19,23)
InChIKey
BQINMKSRVJORFA-UHFFFAOYSA-N
Synonyms

CC1=NN=C(N1CC=C)SCC(=O)NC2=C(C3=C(S2)CCCC3)C#N
InChI=1SC17H19N5OS2c1382211(2)202117(22)241015(23)191613(918)12645714(12)2516h3H14810H22H3(H1923)
MFCD05124094
N(3cyano4567tetrahydro1benzothiophen2yl)2((5methyl4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2((5methyl4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000006909453
ZINC06909453
ZINC6909453

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.