Vitas-M small molecule compound
methyl 4-[(Z)-{2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl]benzoate
Catalog ID
STK818516
SMILES CCCCCCOc1ccc(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 C25H25N3O4S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S/c1-3-4-5-6-15-32-20-13-11-18(12-14-20)22-26-25-28(27-22)23(29)21(33-25)16-17-7-9-19(10-8-17)24(30)31-2/h7-14,16H,3-6,15H2,1-2H3/b21-16-InChIKey
SRBBKAIDPPPBIE-PGMHBOJBSA-NSynonyms
CCCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(C=C4)C(=O)OC)SC3=N2
CCCCCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(cc1)C(=O)OC)c2=O
InChI=1SC25H25N3O4Sc13456153220131118(121420)22262528(2722)23(29)21(3325)16177919(10817)24(30)312h71416H3615H212H3b2116
methyl4((Z)(2(4(hexyloxy)phenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)benzoate
METHYL4((Z)(2(4HEXOXYPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)BENZOATE
MFCD06643102
ZINC000003651045
ZINC03651045
ZINC3651045
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