Vitas-M small molecule compound

N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1-(3-methylbutyl)-5-oxopyrrolidine-3-carboxamide

Catalog ID
STK939248
SMILES COCc1n[nH]/c(=N/C(=O)C2CC(=O)N(C2)CCC(C)C)/s1

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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 C14H22N4O3S MW 326.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H22N4O3S/c1-9(2)4-5-18-7-10(6-12(18)19)13(20)15-14-17-16-11(22-14)8-21-3/h9-10H,4-8H2,1-3H3,(H,15,17,20)
InChIKey
QYGZWPDHZYUFDT-UHFFFAOYSA-N
Synonyms
1190286-02-2
1190286022
CC(C)CCN1CC(CC1=O)C(=O)NC2=NN=C(S2)COC
COCc1n(nH)c(=NC(=O)C2CC(=O)N(C2)CCC(C)C)s1
InChI=1SC14H22N4O3Sc19(2)4518710(612(18)19)13(20)1514171611(2214)8213h910H48H213H3(H151720)
MFCD18179200
N((2Z)5(methoxymethyl)134thiadiazol2(3H)ylidene)1(3methylbutyl)5oxopyrrolidine3carboxamide
ZINC000036365423
ZINC000036365424

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Available files

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