Vitas-M small molecule compound

N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-{[5-(4-methoxybenzyl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanamide

Catalog ID
STL182233
SMILES COc1ccc(cc1)Cc1nnc(n1CC(C)C)SC(C(=O)Nc1sc(c(n1)C)C)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 C22H29N5O2S2 MW 459.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O2S2/c1-13(2)12-27-19(11-17-7-9-18(29-6)10-8-17)25-26-22(27)31-16(5)20(28)24-21-23-14(3)15(4)30-21/h7-10,13,16H,11-12H2,1-6H3,(H,23,24,28)
InChIKey
UYNGVEMKUOPDPJ-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=N1)NC(=O)C(C)SC2=NN=C(N2CC(C)C)CC3=CC=C(C=C3)OC)C
InChI=1SC22H29N5O2S2c113(2)122719(11177918(296)10817)252622(27)3116(5)20(28)24212314(3)15(4)3021h7101316H1112H216H3(H232428)
MFCD22125705
N(45dimethyl13thiazol2yl)2((5((4methoxyphenyl)methyl)4(2methylpropyl)124triazol3yl)sulfanyl)propanamide
N(45dimethyl13thiazol2yl)2((5(4methoxybenzyl)4(2methylpropyl)4H124triazol3yl)sulfanyl)propanamide
ZINC000039772599
ZINC000039772600

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Available files

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