Vitas-M small molecule compound

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

Catalog ID
STL161089
SMILES COc1cccc(c1)C(=O)/N=c\1/[nH]nc(s1)C1CCC1

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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 C14H15N3O2S MW 289.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O2S/c1-19-11-7-3-6-10(8-11)12(18)15-14-17-16-13(20-14)9-4-2-5-9/h3,6-9H,2,4-5H2,1H3,(H,15,17,18)
InChIKey
GDSXVADAAKDBNC-UHFFFAOYSA-N
Synonyms
1282117-11-6
1282117116
COC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)C3CCC3
COc1cccc(c1)C(=O)N=c1(nH)nc(s1)C1CCC1
InChI=1SC14H15N3O2Sc1191173610(811)12(18)1514171613(2014)94259h369H245H21H3(H151718)
MFCD20759259
N((2Z)5cyclobutyl134thiadiazol2(3H)ylidene)3methoxybenzamide
N(5cyclobutyl134thiadiazol2yl)3methoxybenzamide
ZINC000061719503
ZINC61719503

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Available files

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