Vitas-M small molecule compound
5-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl benzoate
Catalog ID
STK961937
SMILES COc1ccc(cc1OC(=O)c1ccccc1)/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 C16H15N3O3S MW 329.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O3S/c1-21-13-8-7-11(10-18-19-16(17)23)9-14(13)22-15(20)12-5-3-2-4-6-12/h2-10H,1H3,(H3,17,19,23)/b18-10+InChIKey
AMJALWSLNUODKC-VCHYOVAHSA-NSynonyms
494759-60-3(5((E)(CARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)2METHOXYPHENYL)BENZOATE
494759603
5((E)(2carbamothioylhydrazinylidene)methyl)2methoxyphenylbenzoate
5(2(AMINOCARBOTHIOYL)CARBOHYDRAZONOYL)2METHOXYPHENYLBENZOATE
COC1=C(C=C(C=C1)C=NNC(=S)N)OC(=O)C2=CC=CC=C2
COc1ccc(cc1OC(=O)c1ccccc1)C=NNC(=S)N
InChI=1SC16H15N3O3Sc121138711(10181916(17)23)914(13)2215(20)125324612h210H1H3(H3171923)b1810+
MFCD02604820
ZINC000008828966
ZINC33317392
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