Vitas-M small molecule compound

4-(4-methoxyphenoxy)-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide

Catalog ID
STK850642
SMILES COc1ccc(cc1)OCCCC(=O)/N=c\1/[nH]nc(s1)C(C)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 C16H21N3O3S MW 335.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O3S/c1-11(2)15-18-19-16(23-15)17-14(20)5-4-10-22-13-8-6-12(21-3)7-9-13/h6-9,11H,4-5,10H2,1-3H3,(H,17,19,20)
InChIKey
QWVWHBWSZQGZLD-UHFFFAOYSA-N
Synonyms
459418-37-2
4(4methoxyphenoxy)N((2Z)5(propan2yl)134thiadiazol2(3H)ylidene)butanamide
4(4METHOXYPHENOXY)N(5(METHYLETHYL)(134THIADIAZOL2YL))BUTANAMIDE
4(4METHOXYPHENOXY)N(5PROPAN2YL134THIADIAZOL2YL)BUTANAMIDE
459418372
CC(C)C1=NN=C(S1)NC(=O)CCCOC2=CC=C(C=C2)OC
COc1ccc(cc1)OCCCC(=O)N=c1(nH)nc(s1)C(C)C
InChI=1SC16H21N3O3Sc111(2)15181916(2315)1714(20)541022138612(213)7913h6911H4510H213H3(H171920)
MFCD07199414
N(5ISOPROPYL(134)THIADIAZOL2YL)4(4METHOXYPHENOXY)BUTYRAMIDE
N(5ISOPROPYL134THIADIAZOL2YL)4(4METHOXYPHENOXY)BUTANAMIDE
ZINC000009108784
ZINC09108784
ZINC9108784

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Available files

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