Vitas-M small molecule compound
N-{[3-chloro-2-(pyrrolidin-1-yl)phenyl]carbamothioyl}-3,4,5-trimethoxybenzamide
Catalog ID
STK519699
SMILES COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1cccc(c1N1CCCC1)Cl
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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/c1-27-16-11-13(12-17(28-2)19(16)29-3)20(26)24-21(30)23-15-8-6-7-14(22)18(15)25-9-4-5-10-25/h6-8,11-12H,4-5,9-10H2,1-3H3,(H2,23,24,26,30)InChIKey
WYOJSEWKHHQPSG-UHFFFAOYSA-NSynonyms
COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)N3CCCC3
InChI=1SC21H24ClN3O4Sc127161113(1217(282)19(16)293)20(26)2421(30)231586714(22)18(15)259451025h681112H45910H213H3(H223242630)
MFCD05831852
N((3chloro2(pyrrolidin1yl)phenyl)carbamothioyl)345trimethoxybenzamide
N((3CHLORO2PYRROLIDIN1YLPHENYL)CARBAMOTHIOYL)345TRIMETHOXYBENZAMIDE
N(3CHLORO2(1PYRROLIDINYL)PHENYL)N(345TRIMETHOXYBENZOYL)THIOUREA
ZINC000001076201
ZINC01076201
ZINC1076201
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