Vitas-M small molecule compound
N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3,5-diethoxybenzamide
Catalog ID
STK347483
SMILES CCOc1cc(OCC)cc(c1)C(=O)NC(=S)Nc1sc2c(c1C#N)CCC(C2)C
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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 C22H25N3O3S2 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3S2/c1-4-27-15-9-14(10-16(11-15)28-5-2)20(26)24-22(29)25-21-18(12-23)17-7-6-13(3)8-19(17)30-21/h9-11,13H,4-8H2,1-3H3,(H2,24,25,26,29)InChIKey
ZZBVMGFDQFHUGN-UHFFFAOYSA-NSynonyms
642422-69-3642422693
CCOC1=CC(=CC(=C1)C(=O)NC(=S)NC2=C(C3=C(S2)CC(CC3)C)C#N)OCC
InChI=1SC22H25N3O3S2c142715914(1016(1115)2852)20(26)2422(29)252118(1223)177613(3)819(17)3021h91113H48H213H3(H224252629)
MFCD03907856
N((3cyano6methyl4567tetrahydro1benzothiophen2yl)carbamothioyl)35diethoxybenzamide
N((3cyano6methyl4567tetrahydrobenzo(b)thiophen2yl)carbamothioyl)35diethoxybenzamide
ZINC000001127635
ZINC000001127636
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