Vitas-M small molecule compound
N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STK076710
SMILES COc1cc(ccc1OC)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 C32H29N5O4S MW 579.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N5O4S/c1-39-28-17-16-25(19-29(28)40-2)31-35-36-32(37(31)26-13-7-4-8-14-26)42-22-30(38)34-33-20-24-12-9-15-27(18-24)41-21-23-10-5-3-6-11-23/h3-20H,21-22H2,1-2H3,(H,34,38)/b33-20+InChIKey
IVVWHUWLTSROTI-FMFFXOCNSA-NSynonyms
(E)N(3(benzyloxy)benzylidene)2((5(34dimethoxyphenyl)4phenyl4H124triazol3yl)thio)acetohydrazide
2((5(34dimethoxyphenyl)4phenyl124triazol3yl)sulfanyl)N((E)(3phenylmethoxyphenyl)methylideneamino)acetamide
COC1=C(C=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC(=CC=C4)OCC5=CC=CC=C5)OC
COc1cc(ccc1OC)c1nnc(n1c1ccccc1)SCC(=O)NN=Cc1cccc(c1)OCc1ccccc1
InChI=1SC32H29N5O4Sc13928171625(1929(28)402)31353632(37(31)26137481426)422230(38)343320241291527(1824)412123105361123h320H2122H212H3(H3438)b3320+
MFCD01841579
N((1E)2(3(PHENYLMETHOXY)PHENYL)1AZAVINYL)2(5(34DIMETHOXYPHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)(3(BENZYLOXY)PHENYL)METHYLIDENE)2((5(34DIMETHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
STK076710
ZINC000097939449
ZINC100302777
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