Vitas-M small molecule compound

4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STL148206
SMILES CC(c1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccnc1)C

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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 C17H17N5S MW 323.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5S/c1-12(2)14-7-5-13(6-8-14)10-19-22-16(20-21-17(22)23)15-4-3-9-18-11-15/h3-12H,1-2H3,(H,21,23)/b19-10+
InChIKey
BCMFXGMPNVFRGF-VXLYETTFSA-N
Synonyms
487037-65-0
4(((E)(4(propan2yl)phenyl)methylidene)amino)5(pyridin3yl)24dihydro3H124triazole3thione
4((1E)2(4(METHYLETHYL)PHENYL)1AZAVINYL)5(3PYRIDYL)124TRIAZOLE3THIOL
4((E)(4PROPAN2YLPHENYL)METHYLIDENEAMINO)3PYRIDIN3YL1H124TRIAZOLE5THIONE
487037650
CC(C)C1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CN=CC=C3
CC(c1ccc(cc1)C=Nn1c(=S)(nH)nc1c1cccnc1)C
InChI=1SC17H17N5Sc112(2)147513(6814)10192216(202117(22)23)15439181115h312H12H3(H2123)b1910+
MFCD03801640
ZINC000001240652
ZINC1240651

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Available files

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