Vitas-M small molecule compound
1-benzyl-N-[(2E)-5-(4-methoxybenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-5-oxopyrrolidine-3-carboxamide
Catalog ID
STK659693
SMILES COc1ccc(cc1)Cc1n[nH]/c(=N\C(=O)C2CC(=O)N(C2)Cc2ccccc2)/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 C22H22N4O3S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S/c1-29-18-9-7-15(8-10-18)11-19-24-25-22(30-19)23-21(28)17-12-20(27)26(14-17)13-16-5-3-2-4-6-16/h2-10,17H,11-14H2,1H3,(H,23,25,28)InChIKey
PNNHRTNKDHUFBC-UHFFFAOYSA-NSynonyms
1144447-59-51144447595
1benzylN((2E)5(4methoxybenzyl)134thiadiazol2(3H)ylidene)5oxopyrrolidine3carboxamide
1benzylN(5((4methoxyphenyl)methyl)134thiadiazol2yl)5oxopyrrolidine3carboxamide
COC1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)C3CC(=O)N(C3)CC4=CC=CC=C4
COc1ccc(cc1)Cc1n(nH)c(=NC(=O)C2CC(=O)N(C2)Cc2ccccc2)s1
InChI=1SC22H22N4O3Sc129189715(81018)1119242522(3019)2321(28)171220(27)26(1417)13165324616h21017H1114H21H3(H232528)
MFCD18168817
ZINC000031815273
ZINC000031815278
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