Vitas-M small molecule compound
4-phenyl-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK952830
SMILES Sc1nnc(n1c1ccccc1)c1csc2c1CCCC2
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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 C16H15N3S2 MW 313.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3S2/c20-16-18-17-15(19(16)11-6-2-1-3-7-11)13-10-21-14-9-5-4-8-12(13)14/h1-3,6-7,10H,4-5,8-9H2,(H,18,20)InChIKey
GDDXIDBQLGUFJG-UHFFFAOYSA-NSynonyms
4phenyl3(4567tetrahydro1benzothiophen3yl)1H124triazole5thione
4phenyl5(4567tetrahydro1benzothiophen3yl)4H124triazole3thiol
C1CCC2=C(C1)C(=CS2)C3=NNC(=S)N3C4=CC=CC=C4
InChI=1SC16H15N3S2c2016181715(19(16)116213711)13102114954812(13)14h136710H4589H2(H1820)
MFCD05827036
ZINC000004749389
ZINC4749389
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