Vitas-M small molecule compound
2-methoxy-4-{(E)-[2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)hydrazinylidene]methyl}phenyl 4-tert-butylbenzoate
Catalog ID
STK249092
SMILES COc1cc(/C=N/Nc2sc(c(n2)c2ccccc2)C)ccc1OC(=O)c1ccc(cc1)C(C)(C)C
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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 C29H29N3O3S MW 499.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O3S/c1-19-26(21-9-7-6-8-10-21)31-28(36-19)32-30-18-20-11-16-24(25(17-20)34-5)35-27(33)22-12-14-23(15-13-22)29(2,3)4/h6-18H,1-5H3,(H,31,32)/b30-18+InChIKey
IBVALZBOXFUFLK-UXHLAJHPSA-NSynonyms
(2methoxy4((E)((5methyl4phenyl13thiazol2yl)hydrazinylidene)methyl)phenyl)4tertbutylbenzoate
2methoxy4((E)(2(5methyl4phenyl13thiazol2yl)hydrazinylidene)methyl)phenyl4tertbutylbenzoate
CC1=C(N=C(S1)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)(C)C)OC)C4=CC=CC=C4
COc1cc(C=NNc2sc(c(n2)c2ccccc2)C)ccc1OC(=O)c1ccc(cc1)C(C)(C)C
InChI=1SC29H29N3O3Sc11926(2197681021)3128(3619)32301820111624(25(1720)345)3527(33)22121423(151322)29(23)4h618H15H3(H3132)b3018+
MFCD03835478
ZINC000009668262
ZINC35126342
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