Vitas-M small molecule compound
2-{[3-(4-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(1Z)-1-(3-nitrophenyl)ethylidene]acetohydrazide
Catalog ID
STK996475
SMILES O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)C)N/N=C(\c1cccc(c1)[N+](=O)[O-])/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 C25H21N5O4S MW 487.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O4S/c1-16-10-12-19(13-11-16)29-24(32)21-8-3-4-9-22(21)26-25(29)35-15-23(31)28-27-17(2)18-6-5-7-20(14-18)30(33)34/h3-14H,15H2,1-2H3,(H,28,31)/b27-17-InChIKey
YAESWQYLRYSUKY-PKAZHMFMSA-NSynonyms
497077-39-1(Z)N(1(3nitrophenyl)ethylidene)2((4oxo3(ptolyl)34dihydroquinazolin2yl)thio)acetohydrazide
2((3(4methylphenyl)4oxo34dihydroquinazolin2yl)sulfanyl)N((1Z)1(3nitrophenyl)ethylidene)acetohydrazide
2(3(4METHYLPHENYL)4OXOQUINAZOLIN2YL)SULFANYLN((Z)1(3NITROPHENYL)ETHYLIDENEAMINO)ACETAMIDE
497077391
CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=C(C)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC25H21N5O4Sc116101219(131116)2924(32)21834922(21)2625(29)351523(31)282717(2)1865720(1418)30(33)34h314H15H212H3(H2831)b2717
MFCD03217557
N((1Z)2(3NITROPHENYL)1AZAPROP1ENYL)2(3(4METHYLPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)C)NN=C(c1cccc(c1)(N+)(=O)(O))C
ZINC000013596857
ZINC1298942
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.