Vitas-M small molecule compound

1-{5-[(1H-indol-5-ylmethyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}-3-methylbutan-1-one

Catalog ID
STK649644
SMILES CC(CC(=O)n1nc(nc1NCc1ccc2c(c1)cc[nH]2)c1cccnc1)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 C21H22N6O MW 374.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O/c1-14(2)10-19(28)27-21(25-20(26-27)17-4-3-8-22-13-17)24-12-15-5-6-18-16(11-15)7-9-23-18/h3-9,11,13-14,23H,10,12H2,1-2H3,(H,24,25,26)
InChIKey
WJBXGRAALHRMEM-UHFFFAOYSA-N
Synonyms
1144478-14-7
1(5(((1Hindol5yl)methyl)amino)3(pyridin3yl)1H124triazol1yl)3methylbutan1one
1(5((1Hindol5ylmethyl)amino)3(pyridin3yl)1H124triazol1yl)3methylbutan1one
1(5(1Hindol5ylmethylamino)3pyridin3yl124triazol1yl)3methylbutan1one
1144478147
CC(C)CC(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC4=C(C=C3)NC=C4
CC(CC(=O)n1nc(nc1NCc1ccc2c(c1)cc(nH)2)c1cccnc1)C
InChI=1SC21H22N6Oc114(2)1019(28)2721(2520(2627)17438221317)241215561816(1115)792318h3911131423H1012H212H3(H242526)
MFCD12216698
ZINC000032101748
ZINC32101748

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Available files

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