Vitas-M small molecule compound
N-{[3-chloro-4-(pyrrolidin-1-yl)phenyl]carbamothioyl}-3,4,5-trimethoxybenzamide
Catalog ID
STK164002
SMILES COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1ccc(c(c1)Cl)N1CCCC1
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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 C21H24ClN3O4S MW 449.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O4S/c1-27-17-10-13(11-18(28-2)19(17)29-3)20(26)24-21(30)23-14-6-7-16(15(22)12-14)25-8-4-5-9-25/h6-7,10-12H,4-5,8-9H2,1-3H3,(H2,23,24,26,30)InChIKey
VDIOBSNRKCFMBG-UHFFFAOYSA-NSynonyms
COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCC3)Cl
InChI=1SC21H24ClN3O4Sc127171013(1118(282)19(17)293)20(26)2421(30)23146716(15(22)1214)25845925h671012H4589H213H3(H223242630)
MFCD03307039
N((3CHLORO4(PYRROLIDIN1YL)PHENYL)CARBAMOTHIOYL)345TRIMETHOXYBENZAMIDE
N((3CHLORO4PYRROLIDIN1YLPHENYL)CARBAMOTHIOYL)345TRIMETHOXYBENZAMIDE
ZINC000001154931
ZINC01154931
ZINC1154931
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