Vitas-M small molecule compound
5-(1-benzothiophen-3-yl)-4-butyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK449698
SMILES CCCCn1c(S)nnc1c1csc2c1cccc2
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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 C14H15N3S2 MW 289.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3S2/c1-2-3-8-17-13(15-16-14(17)18)11-9-19-12-7-5-4-6-10(11)12/h4-7,9H,2-3,8H2,1H3,(H,16,18)InChIKey
LGJBLDKSZRZVQD-UHFFFAOYSA-NSynonyms
3(1BENZOTHIOPHEN3YL)4BUTYL1H124TRIAZOLE5THIONE
5(1BENZOTHIEN3YL)4BUTYL4H124TRIAZOL3YLHYDROSULFIDE
5(1benzothiophen3yl)4butyl4H124triazole3thiol
5BENZO(B)THIOPHEN3YL4BUTYL124TRIAZOLE3THIOL
CCCCN1C(=NNC1=S)C2=CSC3=CC=CC=C32
InChI=1SC14H15N3S2c12381713(151614(17)18)1191912754610(11)12h479H238H21H3(H1618)
MFCD03467261
ZINC000005898076
ZINC05898076
ZINC5898076
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