Vitas-M small molecule compound

N-[(2Z)-5-(1H-indol-3-ylmethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-methoxybenzamide

Catalog ID
STK846597
SMILES COc1ccc(cc1)C(=O)/N=c\1/[nH]nc(s1)Cc1c[nH]c2c1cccc2

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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 C19H16N4O2S MW 364.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O2S/c1-25-14-8-6-12(7-9-14)18(24)21-19-23-22-17(26-19)10-13-11-20-16-5-3-2-4-15(13)16/h2-9,11,20H,10H2,1H3,(H,21,23,24)
InChIKey
AXHAJBIEOINPDH-UHFFFAOYSA-N
Synonyms
340018-27-1
340018271
COC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CC3=CNC4=CC=CC=C43
COc1ccc(cc1)C(=O)N=c1(nH)nc(s1)Cc1c(nH)c2c1cccc2
InChI=1SC19H16N4O2Sc125148612(7914)18(24)2119232217(2619)1013112016532415(13)16h291120H10H21H3(H212324)
MFCD04072496
N((2Z)5(1Hindol3ylmethyl)134thiadiazol2(3H)ylidene)4methoxybenzamide

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Available files

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