Vitas-M small molecule compound
2-({[5-(3-methylphenyl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STL122418
SMILES Cc1cccc(c1)c1nnc(n1CC(C)C)SCc1nc2ccccc2c(=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 C22H23N5OS MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5OS/c1-14(2)12-27-20(16-8-6-7-15(3)11-16)25-26-22(27)29-13-19-23-18-10-5-4-9-17(18)21(28)24-19/h4-11,14H,12-13H2,1-3H3,(H,23,24,28)InChIKey
YXUBVZWMPITJSZ-UHFFFAOYSA-NSynonyms
2(((5(3methylphenyl)4(2methylpropyl)4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
2((5(3methylphenyl)4(2methylpropyl)124triazol3yl)sulfanylmethyl)1Hquinazolin4one
CC1=CC=CC(=C1)C2=NN=C(N2CC(C)C)SCC3=NC(=O)C4=CC=CC=C4N3
Cc1cccc(c1)c1nnc(n1CC(C)C)SCc1nc2ccccc2c(=O)(nH)1
InChI=1SC22H23N5OSc114(2)122720(1686715(3)1116)252622(27)29131923181054917(18)21(28)2419h41114H1213H213H3(H232428)
MFCD18434855
ZINC000009197301
ZINC09197301
ZINC9197301
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