Vitas-M small molecule compound

N-[(2S)-1-oxo-3-phenyl-1-(pyridin-2-ylamino)propan-2-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide

Catalog ID
STK632714
SMILES O=C([C@@H](NC(=O)C1COc2c(O1)cccc2)Cc1ccccc1)Nc1ccccn1

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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 C23H21N3O4 MW 403.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4/c27-22(26-21-12-6-7-13-24-21)17(14-16-8-2-1-3-9-16)25-23(28)20-15-29-18-10-4-5-11-19(18)30-20/h1-13,17,20H,14-15H2,(H,25,28)(H,24,26,27)/t17-,20?/m0/s1
InChIKey
GKSBHTARXJAMEM-DIMJTDRSSA-N
Synonyms
1214632-14-0
1214632140
C1C(OC2=CC=CC=C2O1)C(=O)NC(CC3=CC=CC=C3)C(=O)NC4=CC=CC=N4
InChI=1SC23H21N3O4c2722(26211267132421)17(14168213916)2523(28)2015291810451119(18)3020h1131720H1415H2(H2528)(H242627)t1720?m0s1
MFCD18159866
N((2S)1oxo3phenyl1(pyridin2ylamino)propan2yl)23dihydro14benzodioxine2carboxamide
N((2S)1oxo3phenyl1(pyridin2ylamino)propan2yl)23dihydro14benzodioxine3carboxamide
N((S)1oxo3phenyl1(pyridin2ylamino)propan2yl)23dihydrobenzo(b)(14)dioxine2carboxamide
O=C((C@@H)(NC(=O)C1COc2c(O1)cccc2)Cc1ccccc1)Nc1ccccn1
ZINC000020738363
ZINC000020738367

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Available files

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