Vitas-M small molecule compound

methyl 1-[({3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]-1H-pyrazole-3-carboxylate

Catalog ID
STL390071
SMILES COC(=O)c1ccn(n1)CSc1nc2ccccc2c(=O)n1CCCn1nc(cc1C)C

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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 C22H24N6O3S MW 452.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N6O3S/c1-15-13-16(2)28(24-15)11-6-10-27-20(29)17-7-4-5-8-18(17)23-22(27)32-14-26-12-9-19(25-26)21(30)31-3/h4-5,7-9,12-13H,6,10-11,14H2,1-3H3
InChIKey
DXISXJPEWNHTMD-UHFFFAOYSA-N
Synonyms
1005591-17-2
1005591172
CC1=CC(=NN1CCCN2C(=O)C3=CC=CC=C3N=C2SCN4C=CC(=N4)C(=O)OC)C
InChI=1SC22H24N6O3Sc1151316(2)28(2415)116102720(29)17745818(17)2322(27)32142612919(2526)21(30)313h45791213H6101114H213H3
methyl1(((3(3(35dimethyl1Hpyrazol1yl)propyl)4oxo34dihydroquinazolin2yl)sulfanyl)methyl)1Hpyrazole3carboxylate
methyl1((3(3(35dimethylpyrazol1yl)propyl)4oxoquinazolin2yl)sulfanylmethyl)pyrazole3carboxylate
MFCD06195664
ZINC000002741063
ZINC02741063
ZINC2741063

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Available files

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