Vitas-M small molecule compound

2-[(4-nitrobenzyl)sulfanyl]-3-phenylquinazolin-4(3H)-one

Catalog ID
STK865663
SMILES O=c1n(c2ccccc2)c(SCc2ccc(cc2)[N+](=O)[O-])nc2c1cccc2

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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 C21H15N3O3S MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O3S/c25-20-18-8-4-5-9-19(18)22-21(23(20)16-6-2-1-3-7-16)28-14-15-10-12-17(13-11-15)24(26)27/h1-13H,14H2
InChIKey
FTNSFKAFDNIENS-UHFFFAOYSA-N
Synonyms
329079-89-2
2(((4NITROPHENYL)METHYL)SULFANYL)3PHENYL34DIHYDROQUINAZOLIN4ONE
2((4NITROBENZYL)SULFANYL)3PHENYL4(3H)QUINAZOLINONE
2((4nitrobenzyl)sulfanyl)3phenylquinazolin4(3H)one
2((4NITROBENZYL)THIO)3PHENYL4(3H)QUINAZOLINONE
2((4nitrobenzyl)thio)3phenylquinazolin4(3H)one
2((4NITROPHENYL)METHYLSULFANYL)3PHENYLQUINAZOLIN4ONE
2((4NITROPHENYL)METHYLTHIO)3PHENYL3HYDROQUINAZOLIN4ONE
329079892
C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H15N3O3Sc252018845919(18)2221(23(20)166213716)281415101217(131115)24(26)27h113H14H2
MFCD00514429
O=c1n(c2ccccc2)c(SCc2ccc(cc2)(N+)(=O)(O))nc2c1cccc2
ZINC000001095921
ZINC01095921
ZINC1095921

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.