Vitas-M small molecule compound

2-methyl-4-{3-nitro-4-[(pyridin-3-ylmethyl)amino]phenyl}phthalazin-1(2H)-one

Catalog ID
STK238647
SMILES O=c1n(C)nc(c2c1cccc2)c1ccc(c(c1)[N+](=O)[O-])NCc1cccnc1

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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 C21H17N5O3 MW 387.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O3/c1-25-21(27)17-7-3-2-6-16(17)20(24-25)15-8-9-18(19(11-15)26(28)29)23-13-14-5-4-10-22-12-14/h2-12,23H,13H2,1H3
InChIKey
SIGFRMXLMCAUHJ-UHFFFAOYSA-N
Synonyms
577983-29-0
2methyl4(3nitro4((pyridin3ylmethyl)amino)phenyl)phthalazin1(2H)one
2METHYL4(3NITRO4(PYRIDIN3YLMETHYLAMINO)PHENYL)PHTHALAZIN1ONE
577983290
CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)NCC4=CN=CC=C4)(N+)(=O)(O)
InChI=1SC21H17N5O3c12521(27)17732616(17)20(2425)158918(19(1115)26(28)29)2313145410221214h21223H13H21H3
MFCD04021695
O=c1n(C)nc(c2c1cccc2)c1ccc(c(c1)(N+)(=O)(O))NCc1cccnc1
ZINC000004164394
ZINC04164394
ZINC4164394

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Available files

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