Vitas-M small molecule compound

N-(2-chlorobenzyl)-4-[1-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]butanamide

Catalog ID
STL131616
SMILES COc1ccc(cc1)NC(=O)Cn1c(=O)n(CCCC(=O)NCc2ccccc2Cl)c(=O)c2c1cccc2

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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 C28H27ClN4O5 MW 535.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27ClN4O5/c1-38-21-14-12-20(13-15-21)31-26(35)18-33-24-10-5-3-8-22(24)27(36)32(28(33)37)16-6-11-25(34)30-17-19-7-2-4-9-23(19)29/h2-5,7-10,12-15H,6,11,16-18H2,1H3,(H,30,34)(H,31,35)
InChIKey
NSIOTQIPPGORRZ-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C(=O)N(C2=O)CCCC(=O)NCC4=CC=CC=C4Cl
InChI=1SC28H27ClN4O5c13821141220(131521)3126(35)1833241053822(24)27(36)32(28(33)37)1661125(34)301719724923(19)29h257101215H6111618H21H3(H3034)(H3135)
MFCD14738476
N((2chlorophenyl)methyl)4(1(2(4methoxyanilino)2oxoethyl)24dioxoquinazolin3yl)butanamide
N(2chlorobenzyl)4(1(2((4methoxyphenyl)amino)2oxoethyl)24dioxo14dihydroquinazolin3(2H)yl)butanamide
ZINC000101331329
ZINC101331329

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Available files

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