Vitas-M small molecule compound
5-(1-benzothiophen-3-yl)-4-benzyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK449818
SMILES Sc1nnc(n1Cc1ccccc1)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 C17H13N3S2 MW 323.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3S2/c21-17-19-18-16(20(17)10-12-6-2-1-3-7-12)14-11-22-15-9-5-4-8-13(14)15/h1-9,11H,10H2,(H,19,21)InChIKey
YRBBYYZAGUHNIF-UHFFFAOYSA-NSynonyms
3(1BENZOTHIOPHEN3YL)4BENZYL1H124TRIAZOLE5THIONE
5(1BENZOTHIEN3YL)4BENZYL4H124TRIAZOL3YLHYDROSULFIDE
5(1benzothiophen3yl)4benzyl4H124triazole3thiol
5BENZO(B)THIOPHEN3YL4BENZYL124TRIAZOLE3THIOL
C1=CC=C(C=C1)CN2C(=NNC2=S)C3=CSC4=CC=CC=C43
InChI=1SC17H13N3S2c2117191816(20(17)10126213712)14112215954813(14)15h1911H10H2(H1921)
MFCD03468179
ZINC000000374596
ZINC00374596
ZINC374596
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