Vitas-M small molecule compound
3-[2-oxo-2-(thiophen-2-yl)ethyl]-5-(2-phenylethyl)-1,3,4-thiadiazol-2(3H)-iminium
Catalog ID
STK038436
SMILES O=C(c1cccs1)Cn1nc(sc1=[NH2+])CCc1ccccc1
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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 C16H16N3OS2 MW 330.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3OS2/c17-16-19(11-13(20)14-7-4-10-21-14)18-15(22-16)9-8-12-5-2-1-3-6-12/h1-7,10,17H,8-9,11H2/p+1InChIKey
QMXPAHNTRKOYFD-UHFFFAOYSA-OSynonyms
2(2amino5(2phenylethyl)134thiadiazol3ium3yl)1thiophen2ylethanone
2(2AMINO5PHENETHYL134THIADIAZOL3IUM3YL)1THIOPHEN2YLETHANONE
3(2OXO2(THIOPHEN2YL)ETHYL)5(2PHENYLETHYL)134THIADIAZOL2(3H)IMINIUM
C1=CC=C(C=C1)CCC2=N(N+)(=C(S2)N)CC(=O)C3=CC=CS3
InChI=1SC16H15N3OS2c171619(1113(20)1474102114)1815(2216)98125213612h171017H8911H2p+1
O=C(c1cccs1)Cn1nc(sc1=(NH2+))CCc1ccccc1
STK038436
ZINC000004616381
ZINC33511301
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