Vitas-M small molecule compound

(6-methyl-3,4-dihydroquinolin-1(2H)-yl){1-[(2-nitrophenoxy)methyl]-1H-pyrazol-3-yl}methanone

Catalog ID
STK309389
SMILES Cc1ccc2c(c1)CCCN2C(=O)c1ccn(n1)COc1ccccc1[N+](=O)[O-]

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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 C21H20N4O4 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4/c1-15-8-9-18-16(13-15)5-4-11-24(18)21(26)17-10-12-23(22-17)14-29-20-7-3-2-6-19(20)25(27)28/h2-3,6-10,12-13H,4-5,11,14H2,1H3
InChIKey
WKIJIWMADFYGIJ-UHFFFAOYSA-N
Synonyms
1005589-54-7
(6METHYL34DIHYDRO2HQUINOLIN1YL)(1((2NITROPHENOXY)METHYL)PYRAZOL3YL)METHANONE
(6methyl34dihydroquinolin1(2H)yl)(1((2nitrophenoxy)methyl)1Hpyrazol3yl)methanone
1005589547
CC1=CC2=C(C=C1)N(CCC2)C(=O)C3=NN(C=C3)COC4=CC=CC=C4(N+)(=O)(O)
Cc1ccc2c(c1)CCCN2C(=O)c1ccn(n1)COc1ccccc1(N+)(=O)(O)
InChI=1SC21H20N4O4c115891816(1315)541124(18)21(26)17101223(2217)142920732619(20)25(27)28h236101213H451114H21H3
MFCD04051694
ZINC000002800477
ZINC02800477
ZINC2800477

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Available files

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