Vitas-M small molecule compound
2,4-dichloro-N-[(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)carbamothioyl]benzamide
Catalog ID
STK840451
SMILES N#Cc1c(NC(=S)NC(=O)c2ccc(cc2Cl)Cl)sc2c1CCCCCC2
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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 C19H17Cl2N3OS2 MW 438.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17Cl2N3OS2/c20-11-7-8-13(15(21)9-11)17(25)23-19(26)24-18-14(10-22)12-5-3-1-2-4-6-16(12)27-18/h7-9H,1-6H2,(H2,23,24,25,26)InChIKey
NBCRYYQWNYKOHB-UHFFFAOYSA-NSynonyms
370574-04-224dichloroN((3cyano456789hexahydrocycloocta(b)thiophen2yl)carbamothioyl)benzamide
370574042
C1CCCC2=C(CC1)C(=C(S2)NC(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C#N
InChI=1SC19H17Cl2N3OS2c20117813(15(21)911)17(25)2319(26)241814(1022)1253124616(12)2718h79H16H2(H223242526)
MFCD01994135
ZINC000002316469
ZINC02316469
ZINC2316469
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