Vitas-M small molecule compound

N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-2-{[4,5-bis(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STK021618
SMILES O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C)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 C32H29N5O2S MW 547.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N5O2S/c1-23-11-15-27(16-12-23)31-35-36-32(37(31)28-17-13-24(2)14-18-28)40-22-30(38)34-33-20-26-9-6-10-29(19-26)39-21-25-7-4-3-5-8-25/h3-20H,21-22H2,1-2H3,(H,34,38)/b33-20+
InChIKey
BKELJRYATVBPLA-FMFFXOCNSA-N
Synonyms
488801-81-6
(E)N(3(benzyloxy)benzylidene)2((45diptolyl4H124triazol3yl)thio)acetohydrazide
2((45BIS(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(3PHENYLMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
488801816
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)C)SCC(=O)NN=CC4=CC(=CC=C4)OCC5=CC=CC=C5
InChI=1SC32H29N5O2Sc123111527(161223)31353632(37(31)28171324(2)141828)402230(38)34332026961029(1926)3921257435825h320H2122H212H3(H3438)b3320+
MFCD03091536
N((1E)2(3(PHENYLMETHOXY)PHENYL)1AZAVINYL)2(45BIS(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)(3(BENZYLOXY)PHENYL)METHYLIDENE)2((45BIS(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C)NN=Cc1cccc(c1)OCc1ccccc1
STK021618
ZINC000002343095
ZINC101404551

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Available files

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