Vitas-M small molecule compound
ethyl 2-[({2-[(5-methylthiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK438520
SMILES CCOC(=O)c1c(NC(=S)NNC(=O)c2csc(c2)C)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 C20H25N3O3S3 MW 451.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S3/c1-3-26-19(25)16-14-8-6-4-5-7-9-15(14)29-18(16)21-20(27)23-22-17(24)13-10-12(2)28-11-13/h10-11H,3-9H2,1-2H3,(H,22,24)(H2,21,23,27)InChIKey
KHNVJOSKDWDOAK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=S)NNC(=O)C3=CSC(=C3)C
ethyl2(((2((5methylthiophen3yl)carbonyl)hydrazinyl)carbonothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2(((5methylthiophene3carbonyl)amino)carbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC20H25N3O3S3c132619(25)161486457915(14)2918(16)2120(27)232217(24)131012(2)281113h1011H39H212H3(H2224)(H2212327)
MFCD03945482
ZINC000020168485
ZINC20168485
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