Vitas-M small molecule compound
N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
Catalog ID
STK727932
SMILES N#Cc1c(NC(=S)NC(=O)c2cc(OC)c(c(c2)OC)OC)sc2c1CCC(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 C21H23N3O4S2 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S2/c1-11-5-6-13-14(10-22)20(30-17(13)7-11)24-21(29)23-19(25)12-8-15(26-2)18(28-4)16(9-12)27-3/h8-9,11H,5-7H2,1-4H3,(H2,23,24,25,29)InChIKey
NNKJCFAJJYAGCW-UHFFFAOYSA-NSynonyms
477496-65-4477496654
CC1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC
InChI=1SC21H23N3O4S2c111561314(1022)20(3017(13)711)2421(29)2319(25)12815(262)18(284)16(912)273h8911H57H214H3(H223242529)
MFCD03687590
N((3cyano6methyl4567tetrahydro1benzothiophen2yl)carbamothioyl)345trimethoxybenzamide
N((3cyano6methyl4567tetrahydrobenzo(b)thiophen2yl)carbamothioyl)345trimethoxybenzamide
ZINC000002249841
ZINC000002249842
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