Vitas-M small molecule compound

N'-[(1Z)-1-(4-chlorophenyl)ethylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide

Catalog ID
STL153749
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C(\c2ccc(cc2)Cl)/C)nc2c(c1=O)cccc2

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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 C25H21ClN4O3S MW 492.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN4O3S/c1-16(17-7-9-18(26)10-8-17)28-29-23(31)15-34-25-27-22-6-4-3-5-21(22)24(32)30(25)19-11-13-20(33-2)14-12-19/h3-14H,15H2,1-2H3,(H,29,31)/b28-16-
InChIKey
ACSWGYHPZUNOIV-NTFVMDSBSA-N
Synonyms
612828-52-1
(Z)N(1(4chlorophenyl)ethylidene)2((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)thio)acetohydrazide
612828521
CC(=NNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC)C4=CC=C(C=C4)Cl
COc1ccc(cc1)n1c(SCC(=O)NN=C(c2ccc(cc2)Cl)C)nc2c(c1=O)cccc2
InChI=1SC25H21ClN4O3Sc116(177918(26)10817)282923(31)1534252722643521(22)24(32)30(25)19111320(332)141219h314H15H212H3(H2931)b2816
MFCD03222634
N((1Z)1(4chlorophenyl)ethylidene)2((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)sulfanyl)acetohydrazide
N((1Z)2(4CHLOROPHENYL)1AZAPROP1ENYL)2(3(4METHOXYPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
N((Z)1(4CHLOROPHENYL)ETHYLIDENEAMINO)2(3(4METHOXYPHENYL)4OXOQUINAZOLIN2YL)SULFANYLACETAMIDE
ZINC000013661517
ZINC59752885

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Available files

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