Vitas-M small molecule compound

2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(1E)-1-(pyridin-3-yl)ethylidene]acetohydrazide

Catalog ID
STK104121
SMILES O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C(/c1cccnc1)\C

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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 C24H21N5O2S MW 443.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N5O2S/c1-16-8-3-6-12-21(16)29-23(31)19-10-4-5-11-20(19)26-24(29)32-15-22(30)28-27-17(2)18-9-7-13-25-14-18/h3-14H,15H2,1-2H3,(H,28,30)/b27-17+
InChIKey
XJLQDFZFUDPKGR-WPWMEQJKSA-N
Synonyms
488087-38-3
(E)2((4oxo3(otolyl)34dihydroquinazolin2yl)thio)N(1(pyridin3yl)ethylidene)acetohydrazide
2((3(2METHYLPHENYL)4OXO34DIHYDROQUINAZOLIN2YL)SULFANYL)N((1E)1(PYRIDIN3YL)ETHYLIDENE)ACETOHYDRAZIDE
2(3(2METHYLPHENYL)4OXOQUINAZOLIN2YL)SULFANYLN((E)1PYRIDIN3YLETHYLIDENEAMINO)ACETAMIDE
488087383
CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=C(C)C4=CN=CC=C4
InChI=1SC24H21N5O2Sc1168361221(16)2923(31)1910451120(19)2624(29)321522(30)282717(2)189713251418h314H15H212H3(H2830)b2717+
MFCD03218978
N((1E)2(3PYRIDYL)1AZAPROP1ENYL)2(3(2METHYLPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)NN=C(c1cccnc1)C
ZINC000001259051
ZINC33330564

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Available files

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