Vitas-M small molecule compound
1-{(E)-[2-({[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}naphthalen-2-olate
Catalog ID
STK559222
SMILES COc1cc(ccc1OC)c1n[nH+]c(n1CC)SCC(=O)N/N=C/c1c([O-])ccc2c1cccc2
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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 C25H25N5O4S MW 491.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O4S/c1-4-30-24(17-10-12-21(33-2)22(13-17)34-3)28-29-25(30)35-15-23(32)27-26-14-19-18-8-6-5-7-16(18)9-11-20(19)31/h5-14,31H,4,15H2,1-3H3,(H,27,32)/b26-14+InChIKey
FPWKZHDGKIZRKQ-VULFUBBASA-NSynonyms
496771-52-91((E)(2(((5(34dimethoxyphenyl)4ethyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)naphthalen2olate
496771529
COc1cc(ccc1OC)c1n(nH+)c(n1CC)SCC(=O)NN=Cc1c((O))ccc2c1cccc2
MFCD03218555
ZINC000001477919
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