Vitas-M small molecule compound

N-(3-chloro-4-methoxyphenyl)-2-{[3-(4-ethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide

Catalog ID
STK017154
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)OC)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 C25H22ClN3O4S MW 495.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O4S/c1-3-33-18-11-9-17(10-12-18)29-24(31)19-6-4-5-7-21(19)28-25(29)34-15-23(30)27-16-8-13-22(32-2)20(26)14-16/h4-14H,3,15H2,1-2H3,(H,27,30)
InChIKey
MKBAYIVOZBOAGQ-UHFFFAOYSA-N
Synonyms
499125-13-2
499125132
CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=C(C=C4)OC)Cl
CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)OC)nc2c(c1=O)cccc2
InChI=1SC25H22ClN3O4Sc13331811917(101218)2924(31)19645721(19)2825(29)341523(30)271681322(322)20(26)1416h414H315H212H3(H2730)
MFCD03224434
N(3CHLORO4METHOXYPHENYL)2((3(4ETHOXYPHENYL)4OXO34DIHYDROQUINAZOLIN2YL)SULFANYL)ACETAMIDE
N(3chloro4methoxyphenyl)2((3(4ethoxyphenyl)4oxo34dihydroquinazolin2yl)thio)acetamide
N(3CHLORO4METHOXYPHENYL)2(3(4ETHOXYPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
N(3CHLORO4METHOXYPHENYL)2(3(4ETHOXYPHENYL)4OXOQUINAZOLIN2YL)SULFANYLACETAMIDE
STK017154
ZINC000001132269
ZINC01132269
ZINC1132269

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Available files

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