Vitas-M small molecule compound

3-(4-methoxyphenyl)-N-[(2Z)-5-(tetrahydrofuran-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]propanamide

Catalog ID
STK653999
SMILES COc1ccc(cc1)CCC(=O)/N=c\1/[nH]nc(s1)C1CCCO1

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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 C16H19N3O3S MW 333.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O3S/c1-21-12-7-4-11(5-8-12)6-9-14(20)17-16-19-18-15(23-16)13-3-2-10-22-13/h4-5,7-8,13H,2-3,6,9-10H2,1H3,(H,17,19,20)
InChIKey
CRUPUCJYUYAQDS-UHFFFAOYSA-N
Synonyms
939243-65-9
3(4methoxyphenyl)N((2Z)5(tetrahydrofuran2yl)134thiadiazol2(3H)ylidene)propanamide
3(4methoxyphenyl)N(5(oxolan2yl)134thiadiazol2yl)propanamide
939243659
COC1=CC=C(C=C1)CCC(=O)NC2=NN=C(S2)C3CCCO3
COc1ccc(cc1)CCC(=O)N=c1(nH)nc(s1)C1CCCO1
InChI=1SC16H19N3O3Sc121127411(5812)6914(20)1716191815(2316)1332102213h457813H236910H21H3(H171920)
MFCD18166880
ZINC000028232834
ZINC000028232839

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Available files

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