Vitas-M small molecule compound

1-methyl-N-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1H-indole-3-carboxamide

Catalog ID
STK930839
SMILES CC(Cc1n[nH]/c(=N\C(=O)c2cn(c3c2cccc3)C)/s1)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 C16H18N4OS MW 314.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4OS/c1-10(2)8-14-18-19-16(22-14)17-15(21)12-9-20(3)13-7-5-4-6-11(12)13/h4-7,9-10H,8H2,1-3H3,(H,17,19,21)
InChIKey
NAMUNCMCBPJYPO-UHFFFAOYSA-N
Synonyms
1219552-34-7
1219552347
1methylN((2E)5(2methylpropyl)134thiadiazol2(3H)ylidene)1Hindole3carboxamide
1methylN(5(2methylpropyl)134thiadiazol2yl)indole3carboxamide
CC(C)CC1=NN=C(S1)NC(=O)C2=CN(C3=CC=CC=C32)C
CC(Cc1n(nH)c(=NC(=O)c2cn(c3c2cccc3)C)s1)C
InChI=1SC16H18N4OSc110(2)814181916(2214)1715(21)12920(3)13754611(12)13h47910H8H213H3(H171921)
MFCD18176770
ZINC000040267481
ZINC40267481

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.