Vitas-M small molecule compound
4-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-chloro-6-ethoxyphenyl 4-methoxybenzoate
Catalog ID
STK899300
SMILES CCOc1cc(/C=N/NC(=S)N)cc(c1OC(=O)c1ccc(cc1)OC)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 C18H18ClN3O4S MW 407.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O4S/c1-3-25-15-9-11(10-21-22-18(20)27)8-14(19)16(15)26-17(23)12-4-6-13(24-2)7-5-12/h4-10H,3H2,1-2H3,(H3,20,22,27)/b21-10+InChIKey
PZPQXVDUHQPXTL-UFFVCSGVSA-NSynonyms
402721-01-1(4((E)(CARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)2CHLORO6ETHOXYPHENYL)4METHOXYBENZOATE
4((E)(2carbamothioylhydrazinylidene)methyl)2chloro6ethoxyphenyl4methoxybenzoate
402721011
CCOC1=C(C(=CC(=C1)C=NNC(=S)N)Cl)OC(=O)C2=CC=C(C=C2)OC
CCOc1cc(C=NNC(=S)N)cc(c1OC(=O)c1ccc(cc1)OC)Cl
InChI=1SC18H18ClN3O4Sc132515911(10212218(20)27)814(19)16(15)2617(23)124613(242)7512h410H3H212H3(H3202227)b2110+
MFCD02604773
ZINC000000657654
ZINC33332918
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