Vitas-M small molecule compound
5-[1-{2-[(2,4-difluorophenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-(2-phenylethyl)pentanamide
Catalog ID
STL131542
SMILES O=C(NCCc1ccccc1)CCCCn1c(=O)c2ccccc2n(c1=O)CC(=O)Nc1ccc(cc1F)F
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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 C29H28F2N4O4 MW 534.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28F2N4O4/c30-21-13-14-24(23(31)18-21)33-27(37)19-35-25-11-5-4-10-22(25)28(38)34(29(35)39)17-7-6-12-26(36)32-16-15-20-8-2-1-3-9-20/h1-5,8-11,13-14,18H,6-7,12,15-17,19H2,(H,32,36)(H,33,37)InChIKey
CRNTYEHCGFQWBA-UHFFFAOYSA-NSynonyms
5(1(2((24difluorophenyl)amino)2oxoethyl)24dioxo14dihydroquinazolin3(2H)yl)N(2phenylethyl)pentanamide
5(1(2(24difluoroanilino)2oxoethyl)24dioxoquinazolin3yl)N(2phenylethyl)pentanamide
C1=CC=C(C=C1)CCNC(=O)CCCCN2C(=O)C3=CC=CC=C3N(C2=O)CC(=O)NC4=C(C=C(C=C4)F)F
InChI=1SC29H28F2N4O4c3021131424(23(31)1821)3327(37)19352511541022(25)28(38)34(29(35)39)17761226(36)321615208213920h15811131418H6712151719H2(H3236)(H3337)
MFCD14738440
ZINC000008593701
ZINC8593701
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