Vitas-M small molecule compound
4-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-chloro-6-methoxyphenyl 4-methoxybenzoate
Catalog ID
STK048224
SMILES COc1ccc(cc1)C(=O)Oc1c(Cl)cc(cc1OC)/C=N/NC(=S)N
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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 C17H16ClN3O4S MW 393.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3O4S/c1-23-12-5-3-11(4-6-12)16(22)25-15-13(18)7-10(8-14(15)24-2)9-20-21-17(19)26/h3-9H,1-2H3,(H3,19,21,26)/b20-9+InChIKey
HRLFNGAWUNNBER-AWQFTUOYSA-NSynonyms
732249-61-5(4((E)(carbamothioylhydrazinylidene)methyl)2chloro6methoxyphenyl)4methoxybenzoate
4((E)(2CARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)2CHLORO6METHOXYPHENYL4METHOXYBENZOATE
732249615
COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Cl)C=NNC(=S)N)OC
COc1ccc(cc1)C(=O)Oc1c(Cl)cc(cc1OC)C=NNC(=S)N
InChI=1SC17H16ClN3O4Sc123125311(4612)16(22)251513(18)710(814(15)242)9202117(19)26h39H12H3(H3192126)b209+
MFCD02604799
STK048224
ZINC000002726968
ZINC33737404
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