Vitas-M small molecule compound

N-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-3-nitrobenzamide (non-preferred name)

Catalog ID
STK863135
SMILES O=C1N(NC(=O)c2cccc(c2)[N+](=O)[O-])C(=O)C2C1C1c3ccccc3C2c2c1cccc2

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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 C25H17N3O5 MW 439.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N3O5/c29-23(13-6-5-7-14(12-13)28(32)33)26-27-24(30)21-19-15-8-1-2-9-16(15)20(22(21)25(27)31)18-11-4-3-10-17(18)19/h1-12,19-22H,(H,26,29)
InChIKey
HCDDZWVHQRODCH-UHFFFAOYSA-N
Synonyms
321945-63-5
321945635
C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)NC(=O)C6=CC(=CC=C6)(N+)(=O)(O)
InChI=1SC25H17N3O5c2923(1365714(1213)28(32)33)262724(30)211915812916(15)20(22(21)25(27)31)1811431017(18)19h1121922H(H2629)
MFCD00315670
N((9R10R15S)1214dioxo11121415tetrahydro9H910(34)epipyrroloanthracen13(10H)yl)3nitrobenzamide
N(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)3nitrobenzamide(nonpreferredname)
O=C1N(NC(=O)c2cccc(c2)(N+)(=O)(O))C(=O)(C@@H)2C1C1c3ccccc3C2c2c1cccc2
O=C1N(NC(=O)c2cccc(c2)(N+)(=O)(O))C(=O)C2C1C1c3ccccc3C2c2c1cccc2
ZINC000000971272
ZINC000018285062

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Available files

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