Vitas-M small molecule compound
2-(3-methylbutyl)-1-oxo-N-[(2E)-1,3,4-thiadiazol-2(3H)-ylidene]-1,2-dihydroisoquinoline-4-carboxamide
Catalog ID
STL242108
SMILES CC(CCn1cc(C(=O)/N=c\2/scn[nH]2)c2c(c1=O)cccc2)C
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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 C17H18N4O2S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O2S/c1-11(2)7-8-21-9-14(15(22)19-17-20-18-10-24-17)12-5-3-4-6-13(12)16(21)23/h3-6,9-11H,7-8H2,1-2H3,(H,19,20,22)InChIKey
LLEYTXCHLNIIRC-UHFFFAOYSA-NSynonyms
1324079-67-51324079675
2(3methylbutyl)1oxoN((2E)134thiadiazol2(3H)ylidene)12dihydroisoquinoline4carboxamide
2(3methylbutyl)1oxoN(134thiadiazol2yl)isoquinoline4carboxamide
CC(C)CCN1C=C(C2=CC=CC=C2C1=O)C(=O)NC3=NN=CS3
CC(CCn1cc(C(=O)N=c2scn(nH)2)c2c(c1=O)cccc2)C
InChI=1SC17H18N4O2Sc111(2)7821914(15(22)19172018102417)12534613(12)16(21)23h36911H78H212H3(H192022)
MFCD24859196
ZINC000071285287
ZINC71285287
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