Vitas-M small molecule compound

3-({2-[(4-tert-butylphenyl)carbonyl]hydrazinyl}carbonyl)bicyclo[2.2.1]heptane-2-carboxylic acid

Catalog ID
STK427534
SMILES O=C(C1C2CCC(C1C(=O)O)C2)NNC(=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 C20H26N2O4 MW 358.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O4/c1-20(2,3)14-8-6-11(7-9-14)17(23)21-22-18(24)15-12-4-5-13(10-12)16(15)19(25)26/h6-9,12-13,15-16H,4-5,10H2,1-3H3,(H,21,23)(H,22,24)(H,25,26)
InChIKey
GAYMGQARULLISQ-UHFFFAOYSA-N
Synonyms

2(((4TERTBUTYLBENZOYL)AMINO)CARBAMOYL)BICYCLO(221)HEPTANE3CARBOXYLICACID
3((2((4tertbutylphenyl)carbonyl)hydrazinyl)carbonyl)bicyclo(221)heptane2carboxylicacid
3(N((4(TERTBUTYL)PHENYL)CARBONYLAMINO)CARBAMOYL)BICYCLO(221)HEPTANE2CARBOXYLICACID
CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=O)C2C3CCC(C3)C2C(=O)O
InChI=1SC20H26N2O4c120(23)148611(7914)17(23)212218(24)15124513(1012)16(15)19(25)26h6912131516H4510H213H3(H2123)(H2224)(H2526)
MFCD02612504
ZINC000102198859
ZINC000135936275

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Available files

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