Vitas-M small molecule compound
1-(2,3-dihydro-1H-indol-1-yl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propan-1-one
Catalog ID
STK497907
SMILES C=CCn1c(nnc1c1ccncc1)SC(C(=O)N1CCc2c1cccc2)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 C21H21N5OS MW 391.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5OS/c1-3-13-26-19(17-8-11-22-12-9-17)23-24-21(26)28-15(2)20(27)25-14-10-16-6-4-5-7-18(16)25/h3-9,11-12,15H,1,10,13-14H2,2H3InChIKey
AUPUKQIYSQWPDY-UHFFFAOYSA-NSynonyms
1(23dihydro1Hindol1yl)2((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)propan1one
1(23DIHYDROINDOL1YL)2((4PROP2ENYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)PROPAN1ONE
CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(N3CC=C)C4=CC=NC=C4
InChI=1SC21H21N5OSc13132619(178112212917)232421(26)2815(2)20(27)25141016645718(16)25h39111215H1101314H22H3
MFCD07666864
ZINC000006907779
ZINC000006907780
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