Vitas-M small molecule compound

(4-tert-butylphenyl)[(3S)-2-ethyl-3-methyl-4-(phenylamino)-3,4-dihydroquinolin-1(2H)-yl]methanone

Catalog ID
STK024166
SMILES CCC1[C@@H](C)C(Nc2ccccc2)c2c(N1C(=O)c1ccc(cc1)C(C)(C)C)cccc2

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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 C29H34N2O MW 426.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O/c1-6-25-20(2)27(30-23-12-8-7-9-13-23)24-14-10-11-15-26(24)31(25)28(32)21-16-18-22(19-17-21)29(3,4)5/h7-20,25,27,30H,6H2,1-5H3/t20-,25?,27?/m1/s1
InChIKey
NTPVNNGNFGYPRG-VYVOKACLSA-N
Synonyms

((3S)4anilino2ethyl3methyl34dihydro2Hquinolin1yl)(4tertbutylphenyl)methanone
(4(tertbutyl)phenyl)(2ethyl3methyl4(phenylamino)34dihydroquinolin1(2H)yl)methanone
(4TERTBUTYLPHENYL)((3S)2ETHYL3METHYL4(PHENYLAMINO)34DIHYDROQUINOLIN1(2H)YL)METHANONE
CCC1(C@@H)(C)C(Nc2ccccc2)c2c(N1C(=O)c1ccc(cc1)C(C)(C)C)cccc2
CCC1C(C(C2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)C(C)(C)C)NC4=CC=CC=C4)C
CCC1C(C)C(Nc2ccccc2)c2c(N1C(=O)c1ccc(cc1)C(C)(C)C)cccc2
InChI=1SC29H34N2Oc162520(2)27(3023128791323)241410111526(24)31(25)28(32)21161822(191721)29(34)5h720252730H6H215H3t2025?27?m1s1
MFCD13368301
STK024166
ZINC000004561815
ZINC000004561821

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Available files

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