Vitas-M small molecule compound

4-methoxy-N-{2-[5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide

Catalog ID
STL122291
SMILES C=CCn1c(CCNC(=O)c2ccc(cc2)OC)nnc1SCc1nc2ccccc2c(=O)[nH]1

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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 C24H24N6O3S MW 476.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N6O3S/c1-3-14-30-21(12-13-25-22(31)16-8-10-17(33-2)11-9-16)28-29-24(30)34-15-20-26-19-7-5-4-6-18(19)23(32)27-20/h3-11H,1,12-15H2,2H3,(H,25,31)(H,26,27,32)
InChIKey
GVXXEXKMTYGCRK-UHFFFAOYSA-N
Synonyms

4methoxyN(2(5(((4oxo34dihydroquinazolin2yl)methyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)ethyl)benzamide
4methoxyN(2(5((4oxo1Hquinazolin2yl)methylsulfanyl)4prop2enyl124triazol3yl)ethyl)benzamide
C=CCn1c(CCNC(=O)c2ccc(cc2)OC)nnc1SCc1nc2ccccc2c(=O)(nH)1
COC1=CC=C(C=C1)C(=O)NCCC2=NN=C(N2CC=C)SCC3=NC(=O)C4=CC=CC=C4N3
InChI=1SC24H24N6O3Sc13143021(12132522(31)1681017(332)11916)282924(30)3415202619754618(19)23(32)2720h311H11215H22H3(H2531)(H262732)
MFCD18434859
ZINC000057291774
ZINC57291774

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Available files

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