Vitas-M small molecule compound

2-{[5-(1H-benzotriazol-1-ylmethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-pyridin-4-ylmethylidene]acetohydrazide

Catalog ID
STK958514
SMILES C=CCn1c(SCC(=O)N/N=C/c2ccncc2)nnc1Cn1nnc2c1cccc2

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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 C20H19N9OS MW 433.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N9OS/c1-2-11-28-18(13-29-17-6-4-3-5-16(17)23-27-29)24-26-20(28)31-14-19(30)25-22-12-15-7-9-21-10-8-15/h2-10,12H,1,11,13-14H2,(H,25,30)/b22-12+
InChIKey
NYLBFDXSDBENMA-WSDLNYQXSA-N
Synonyms
353774-71-7
2((4ALLYL5(1H123BENZOTRIAZOL1YLMETHYL)4H124TRIAZOL3YL)SULFANYL)N(4PYRIDINYLMETHYLENE)ACETOHYDRAZIDE
2((5(1Hbenzotriazol1ylmethyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N((E)pyridin4ylmethylidene)acetohydrazide
2((5(benzotriazol1ylmethyl)4prop2enyl124triazol3yl)sulfanyl)N((E)pyridin4ylmethylideneamino)acetamide
353774717
C=CCN1C(=NN=C1SCC(=O)NN=CC2=CC=NC=C2)CN3C4=CC=CC=C4N=N3
C=CCn1c(SCC(=O)NN=Cc2ccncc2)nnc1Cn1nnc2c1cccc2
InChI=1SC20H19N9OSc12112818(132917643516(17)232729)242620(28)311419(30)25221215792110815h21012H1111314H2(H2530)b2212+
MFCD01614273
ZINC000000998625
ZINC33291070

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Available files

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