Vitas-M small molecule compound
3-(cycloheptylideneamino)-2-(3-nitrophenyl)-2,3-dihydroquinazolin-4(1H)-one
Catalog ID
STK675496
SMILES O=C1N(N=C2CCCCCC2)C(Nc2c1cccc2)c1cccc(c1)[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 C21H22N4O3 MW 378.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3/c26-21-18-12-5-6-13-19(18)22-20(15-8-7-11-17(14-15)25(27)28)24(21)23-16-9-3-1-2-4-10-16/h5-8,11-14,20,22H,1-4,9-10H2InChIKey
WTWZLIXUSAEWHQ-UHFFFAOYSA-NSynonyms
(2R)3(CYCLOHEPTYLIDENEAMINO)2(3NITROPHENYL)23DIHYDROQUINAZOLIN4(1H)ONE
(2S)3(CYCLOHEPTYLIDENEAMINO)2(3NITROPHENYL)23DIHYDROQUINAZOLIN4(1H)ONE
3(CYCLOHEPTYLIDENEAMINO)2(3NITROPHENYL)12DIHYDROQUINAZOLIN4ONE
3(cycloheptylideneamino)2(3nitrophenyl)23dihydroquinazolin4(1H)one
3(CYCLOHEPTYLIDENEAZAMETHYL)2(3NITROPHENYL)123TRIHYDROQUINAZOLIN4ONE
C1CCCC(=NN2C(NC3=CC=CC=C3C2=O)C4=CC(=CC=C4)(N+)(=O)(O))CC1
InChI=1SC21H22N4O3c26211812561319(18)2220(15871117(1415)25(27)28)24(21)2316931241016h5811142022H14910H2
MFCD01821946
O=C1N(N=C2CCCCCC2)C(Nc2c1cccc2)c1cccc(c1)(N+)(=O)(O)
ZINC000001426351
ZINC000001426352
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