Vitas-M small molecule compound
methyl 4-[(Z)-{6-oxo-2-[4-(prop-2-en-1-yloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl]benzoate
Catalog ID
STK817704
SMILES C=CCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1ccc(cc1)C(=O)OC)/c2=O
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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 C22H17N3O4S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4S/c1-3-12-29-17-10-8-15(9-11-17)19-23-22-25(24-19)20(26)18(30-22)13-14-4-6-16(7-5-14)21(27)28-2/h3-11,13H,1,12H2,2H3/b18-13-InChIKey
FPGDSNSSMDDLKK-AQTBWJFISA-NSynonyms
C=CCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(cc1)C(=O)OC)c2=O
COC(=O)C1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCC=C)S2
InChI=1SC22H17N3O4Sc1312291710815(91117)19232225(2419)20(26)18(3022)13144616(7514)21(27)282h31113H112H22H3b1813
methyl4((Z)(6oxo2(4(prop2en1yloxy)phenyl)(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)benzoate
METHYL4((Z)(6OXO2(4PROP2ENOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)BENZOATE
MFCD04447513
ZINC000016736419
ZINC16736419
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