Vitas-M small molecule compound

N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-[2-methyl-4-oxo-6-(prop-2-en-1-yloxy)quinazolin-3(4H)-yl]benzamide

Catalog ID
STK633995
SMILES C=CCOc1ccc2c(c1)c(=O)n(c(n2)C)c1ccc(cc1)C(=O)NC1CCS(=O)(=O)C1

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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 C23H23N3O5S MW 453.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O5S/c1-3-11-31-19-8-9-21-20(13-19)23(28)26(15(2)24-21)18-6-4-16(5-7-18)22(27)25-17-10-12-32(29,30)14-17/h3-9,13,17H,1,10-12,14H2,2H3,(H,25,27)
InChIKey
ODFXFOSZGNTLDL-UHFFFAOYSA-N
Synonyms
1081133-20-1
1081133201
4(6(allyloxy)2methyl4oxoquinazolin3(4H)yl)N(11dioxidotetrahydrothiophen3yl)benzamide
CC1=NC2=C(C=C(C=C2)OCC=C)C(=O)N1C3=CC=C(C=C3)C(=O)NC4CCS(=O)(=O)C4
InChI=1SC23H23N3O5Sc13113119892120(1319)23(28)26(15(2)2421)186416(5718)22(27)2517101232(2930)1417h391317H1101214H22H3(H2527)
MFCD12205676
N(11dioxidotetrahydrothiophen3yl)4(2methyl4oxo6(prop2en1yloxy)quinazolin3(4H)yl)benzamide
N(11dioxothiolan3yl)4(2methyl4oxo6prop2enoxyquinazolin3yl)benzamide
ZINC000020717331
ZINC000020717335

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Available files

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