Vitas-M small molecule compound
1-(3-methoxyphenyl)-5-oxo-N-[(2E)-5-(phenoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]pyrrolidine-3-carboxamide
Catalog ID
STL161470
SMILES COc1cccc(c1)N1CC(CC1=O)C(=O)/N=c/1\[nH]nc(s1)COc1ccccc1
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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 C21H20N4O4S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4S/c1-28-17-9-5-6-15(11-17)25-12-14(10-19(25)26)20(27)22-21-24-23-18(30-21)13-29-16-7-3-2-4-8-16/h2-9,11,14H,10,12-13H2,1H3,(H,22,24,27)InChIKey
PTWWLIGLLRGWCH-UHFFFAOYSA-NSynonyms
1246073-94-81(3methoxyphenyl)5oxoN((2E)5(phenoxymethyl)134thiadiazol2(3H)ylidene)pyrrolidine3carboxamide
1246073948
COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)COC4=CC=CC=C4
COc1cccc(c1)N1CC(CC1=O)C(=O)N=c1(nH)nc(s1)COc1ccccc1
InChI=1SC21H20N4O4Sc1281795615(1117)251214(1019(25)26)20(27)2221242318(3021)1329167324816h291114H101213H21H3(H222427)
MFCD20759390
ZINC000049550961
ZINC000049550963
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