Vitas-M small molecule compound
N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STK088957
SMILES COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)N/N=C/c1cccc(c1)OCc1ccccc1
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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 C31H27N5O3S MW 549.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N5O3S/c1-38-27-17-15-25(16-18-27)30-34-35-31(36(30)26-12-6-3-7-13-26)40-22-29(37)33-32-20-24-11-8-14-28(19-24)39-21-23-9-4-2-5-10-23/h2-20H,21-22H2,1H3,(H,33,37)/b32-20+InChIKey
SPUNDJNCOVFDSJ-UZWMFBFFSA-NSynonyms
(Z)N(3(benzyloxy)benzylidene)2((5(4methoxyphenyl)4phenyl4H124triazol3yl)thio)acetohydrazide
2((5(4METHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)(3PHENYLMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC(=CC=C4)OCC5=CC=CC=C5
COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)NN=Cc1cccc(c1)OCc1ccccc1
InChI=1SC31H27N5O3Sc13827171525(161827)30343531(36(30)26126371326)402229(37)333220241181428(1924)39212394251023h220H2122H21H3(H3337)b3220+
MFCD02669832
N((E)(3(BENZYLOXY)PHENYL)METHYLIDENE)2((5(4METHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
STK088957
ZINC000002349853
ZINC100342394
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