Vitas-M small molecule compound
4-{[4-(propan-2-yl)benzyl]amino}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK232842
SMILES CC(c1ccc(cc1)CNn1cnnc1S)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 C12H16N4S MW 248.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4S/c1-9(2)11-5-3-10(4-6-11)7-14-16-8-13-15-12(16)17/h3-6,8-9,14H,7H2,1-2H3,(H,15,17)InChIKey
IRCSQYKZRHWKFE-UHFFFAOYSA-NSynonyms
869951-08-64((4(PROPAN2YL)BENZYL)AMINO)4H124TRIAZOLE3THIOL
4((4ISOPROPYLBENZYL)AMINO)4H124TRIAZOLE3THIOL
4((4PROPAN2YLPHENYL)METHYLAMINO)1H124TRIAZOLE5THIONE
869951086
CC(C)C1=CC=C(C=C1)CNN2C=NNC2=S
InChI=1SC12H16N4Sc19(2)115310(4611)714168131512(16)17h368914H7H212H3(H1517)
MFCD04565708
ZINC000005901992
ZINC05901992
ZINC5901992
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