Vitas-M small molecule compound
4-[(E)-{2-[(4-tert-butylphenyl)carbonyl]hydrazinylidene}methyl]-2-ethoxyphenyl 2-iodobenzoate
Catalog ID
STK165921
SMILES CCOc1cc(/C=N/NC(=O)c2ccc(cc2)C(C)(C)C)ccc1OC(=O)c1ccccc1I
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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 C27H27IN2O4 MW 570.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27IN2O4/c1-5-33-24-16-18(10-15-23(24)34-26(32)21-8-6-7-9-22(21)28)17-29-30-25(31)19-11-13-20(14-12-19)27(2,3)4/h6-17H,5H2,1-4H3,(H,30,31)/b29-17+InChIKey
BMSKHFITZLWHPR-STBIYBPSSA-NSynonyms
(4((E)((4tertbutylbenzoyl)hydrazinylidene)methyl)2ethoxyphenyl)2iodobenzoate
4((1E)2((4(TERTBUTYL)PHENYL)CARBONYLAMINO)2AZAVINYL)2ETHOXYPHENYL2IODOBENZOATE
4((E)(2((4TERTBUTYLPHENYL)CARBONYL)HYDRAZINYLIDENE)METHYL)2ETHOXYPHENYL2IODOBENZOATE
CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC=C(C=C2)C(C)(C)C)OC(=O)C3=CC=CC=C3I
CCOc1cc(C=NNC(=O)c2ccc(cc2)C(C)(C)C)ccc1OC(=O)c1ccccc1I
InChI=1SC27H27IN2O4c1533241618(101523(24)3426(32)21867922(21)28)17293025(31)19111320(141219)27(23)4h617H5H214H3(H3031)b2917+
MFCD02068079
ZINC000097961932
ZINC100224507
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