Vitas-M small molecule compound

4-methylphenyl 4-[(4-bromophenyl)amino]-4-oxobutanoate

Catalog ID
STK075212
SMILES O=C(Nc1ccc(cc1)Br)CCC(=O)Oc1ccc(cc1)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 C17H16BrNO3 MW 362.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrNO3/c1-12-2-8-15(9-3-12)22-17(21)11-10-16(20)19-14-6-4-13(18)5-7-14/h2-9H,10-11H2,1H3,(H,19,20)
InChIKey
ZAVSICYFTFFVTA-UHFFFAOYSA-N
Synonyms

(4METHYLPHENYL)4(4BROMOANILINO)4OXOBUTANOATE
4METHYLPHENYL3(N(4BROMOPHENYL)CARBAMOYL)PROPANOATE
4METHYLPHENYL4((4BROMOPHENYL)AMINO)4OXOBUTANOATE
4METHYLPHENYL4(4BROMOANILINO)4OXOBUTANOATE
CC1=CC=C(C=C1)OC(=O)CCC(=O)NC2=CC=C(C=C2)Br
InChI=1SC17H16BrNO3c1122815(9312)2217(21)111016(20)19146413(18)5714h29H1011H21H3(H1920)
MFCD02813787
O=C(Nc1ccc(cc1)Br)CCC(=O)Oc1ccc(cc1)C
STK075212
ZINC000000672692
ZINC00672692
ZINC672692

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Available files

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