Vitas-M small molecule compound
N-(5-chloro-2-methoxyphenyl)-2-{[(E)-pyridin-4-ylmethylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK385389
SMILES COc1ccc(cc1NC(=O)c1c(/N=C/c2ccncc2)sc2c1CCCC2)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 C22H20ClN3O2S MW 425.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN3O2S/c1-28-18-7-6-15(23)12-17(18)26-21(27)20-16-4-2-3-5-19(16)29-22(20)25-13-14-8-10-24-11-9-14/h6-13H,2-5H2,1H3,(H,26,27)/b25-13+InChIKey
AHNBDHRWQSJQSB-DHRITJCHSA-NSynonyms
COC1=C(C=C(C=C1)Cl)NC(=O)C2=C(SC3=C2CCCC3)N=CC4=CC=NC=C4
COc1ccc(cc1NC(=O)c1c(N=Cc2ccncc2)sc2c1CCCC2)Cl
InChI=1SC22H20ClN3O2Sc128187615(23)1217(18)2621(27)2016423519(16)2922(20)2513148102411914h613H25H21H3(H2627)b2513+
MFCD03616437
N(5chloro2methoxyphenyl)2(((E)pyridin4ylmethylidene)amino)4567tetrahydro1benzothiophene3carboxamide
N(5chloro2methoxyphenyl)2((E)pyridin4ylmethylideneamino)4567tetrahydro1benzothiophene3carboxamide
ZINC000101892592
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