Vitas-M small molecule compound
1-(1,3-benzothiazol-2-yl)-5-(3-methylphenyl)-1,2-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL150728
SMILES Cc1cccc(c1)c1nc(=S)[nH]n1c1nc2c(s1)cccc2
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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 C16H12N4S2 MW 324.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4S2/c1-10-5-4-6-11(9-10)14-18-15(21)19-20(14)16-17-12-7-2-3-8-13(12)22-16/h2-9H,1H3,(H,19,21)InChIKey
LWJUSPUGUPUBTB-UHFFFAOYSA-NSynonyms
443672-77-31(13benzothiazol2yl)5(3methylphenyl)12dihydro3H124triazole3thione
1BENZOTHIAZOL2YL5MTOLYL1H(124)TRIAZOLE3THIOL
2(13BENZOTHIAZOL2YL)3(3METHYLPHENYL)1H124TRIAZOLE5THIONE
443672773
CC1=CC=CC(=C1)C2=NC(=S)NN2C3=NC4=CC=CC=C4S3
Cc1cccc(c1)c1nc(=S)(nH)n1c1nc2c(s1)cccc2
InChI=1SC16H12N4S2c11054611(910)141815(21)1920(14)161712723813(12)2216h29H1H3(H1921)
MFCD03797944
ZINC000195751803
ZINC195751803
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