Vitas-M small molecule compound

(4Z)-4-[4-(diethylamino)benzylidene]-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK743490
SMILES CCN(c1ccc(cc1)/C=C\1/C(=NN(C1=O)c1nnn[nH]1)C)CC

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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 C16H19N7O MW 325.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N7O/c1-4-22(5-2)13-8-6-12(7-9-13)10-14-11(3)19-23(15(14)24)16-17-20-21-18-16/h6-10H,4-5H2,1-3H3,(H,17,18,20,21)/b14-10-
InChIKey
YIPHBIMDCRKNQH-UVTDQMKNSA-N
Synonyms

(4Z)4((4(DIETHYLAMINO)PHENYL)METHYLIDENE)5METHYL2(2HTETRAZOL5YL)PYRAZOL3ONE
(4Z)4(4(diethylamino)benzylidene)5methyl2(1Htetrazol5yl)24dihydro3Hpyrazol3one
CCN(c1ccc(cc1)C=C1C(=NN(C1=O)c1nnn(nH)1)C)CC
CCN(CC)C1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=NNN=N3)C
InChI=1SC16H19N7Oc1422(52)138612(7913)101411(3)1923(15(14)24)161720211816h610H45H213H3(H17182021)b1410
MFCD05130514
ZINC000019873804
ZINC19873804

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Available files

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