Vitas-M small molecule compound
3-(2,1,3-benzoxadiazol-4-yl)-1-(3-methoxypropyl)-1-[(2-oxo-1,2-dihydroquinolin-4-yl)methyl]thiourea
Catalog ID
STK638784
SMILES COCCCN(C(=S)Nc1cccc2c1non2)Cc1cc(=O)[nH]c2c1cccc2
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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 C21H21N5O3S MW 423.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O3S/c1-28-11-5-10-26(13-14-12-19(27)22-16-7-3-2-6-15(14)16)21(30)23-17-8-4-9-18-20(17)25-29-24-18/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,22,27)(H,23,30)InChIKey
OLBPKDNWDFUUKG-UHFFFAOYSA-NSynonyms
951931-46-73(213benzoxadiazol4yl)1(3methoxypropyl)1((2oxo12dihydroquinolin4yl)methyl)thiourea
3(213benzoxadiazol4yl)1(3methoxypropyl)1((2oxo1Hquinolin4yl)methyl)thiourea
951931467
COCCCN(C(=S)Nc1cccc2c1non2)Cc1cc(=O)(nH)c2c1cccc2
COCCCN(CC1=CC(=O)NC2=CC=CC=C21)C(=S)NC3=CC=CC4=NON=C43
InChI=1SC21H21N5O3Sc1281151026(13141219(27)2216732615(14)16)21(30)23178491820(17)25292418h246912H5101113H21H3(H2227)(H2330)
MFCD18161788
ZINC000013684015
ZINC13684015
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