Vitas-M small molecule compound

methyl (2Z)-2-{[(1-methyl-5-oxopyrrolidin-3-yl)carbonyl]imino}-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate

Catalog ID
STL243236
SMILES COC(=O)c1[nH]/c(=N/C(=O)C2CC(=O)N(C2)C)/sc1C(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 C14H19N3O4S MW 325.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19N3O4S/c1-7(2)11-10(13(20)21-4)15-14(22-11)16-12(19)8-5-9(18)17(3)6-8/h7-8H,5-6H2,1-4H3,(H,15,16,19)
InChIKey
BOPYBLJICAMNBD-UHFFFAOYSA-N
Synonyms
1374529-98-2
1374529982
CC(C)C1=C(N=C(S1)NC(=O)C2CC(=O)N(C2)C)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)C2CC(=O)N(C2)C)sc1C(C)C
InChI=1SC14H19N3O4Sc17(2)1110(13(20)214)1514(2211)1612(19)859(18)17(3)68h78H56H214H3(H151619)
methyl(2Z)2(((1methyl5oxopyrrolidin3yl)carbonyl)imino)5(propan2yl)23dihydro13thiazole4carboxylate
methyl2((1methyl5oxopyrrolidine3carbonyl)amino)5propan2yl13thiazole4carboxylate
MFCD24859574
ZINC000072406042
ZINC000072406043

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Available files

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