Vitas-M small molecule compound

2-{[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide

Catalog ID
STL108274
SMILES O=C(Nc1ccc(c(c1)F)C)CSc1nc2ccccc2c(=O)n1Cc1ccc2c(c1)OCO2

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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 C25H20FN3O4S MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN3O4S/c1-15-6-8-17(11-19(15)26)27-23(30)13-34-25-28-20-5-3-2-4-18(20)24(31)29(25)12-16-7-9-21-22(10-16)33-14-32-21/h2-11H,12-14H2,1H3,(H,27,30)
InChIKey
UQGIMILOCQWHPT-UHFFFAOYSA-N
Synonyms

2((3(13benzodioxol5ylmethyl)4oxo34dihydroquinazolin2yl)sulfanyl)N(3fluoro4methylphenyl)acetamide
2(3(13benzodioxol5ylmethyl)4oxoquinazolin2yl)sulfanylN(3fluoro4methylphenyl)acetamide
CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5)F
InChI=1SC25H20FN3O4Sc1156817(1119(15)26)2723(30)1334252820532418(20)24(31)29(25)1216792122(1016)33143221h211H1214H21H3(H2730)
MFCD20742775
ZINC000067291103
ZINC67291103

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Available files

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