Vitas-M small molecule compound
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(4-ethyl-5-{2-[(2-methylphenyl)amino]-2-oxoethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]propanamide
Catalog ID
STK222015
SMILES CCn1c(nnc1CC(=O)Nc1ccccc1C)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 C21H26N6O2S2 MW 458.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6O2S2/c1-6-27-17(11-18(28)23-16-10-8-7-9-12(16)2)25-26-21(27)31-15(5)19(29)24-20-22-13(3)14(4)30-20/h7-10,15H,6,11H2,1-5H3,(H,23,28)(H,22,24,29)InChIKey
CDFPCBAVXFPQRV-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SC(C)C(=O)NC2=NC(=C(S2)C)C)CC(=O)NC3=CC=CC=C3C
InChI=1SC21H26N6O2S2c162717(1118(28)23161087912(16)2)252621(27)3115(5)19(29)24202213(3)14(4)3020h71015H611H215H3(H2328)(H222429)
MFCD07401439
N(45dimethyl13thiazol2yl)2((4ethyl5(2((2methylphenyl)amino)2oxoethyl)4H124triazol3yl)sulfanyl)propanamide
N(45DIMETHYL13THIAZOL2YL)2((4ETHYL5(2(2METHYLANILINO)2OXOETHYL)124TRIAZOL3YL)SULFANYL)PROPANAMIDE
N(45DIMETHYLTHIAZOL2YL)2(4ETHYL5(OTOLYLCARBAMOYLMETHYL)4H(124)TRIAZOL3YLSULFANYL)PROPIONAMIDE
ZINC000009303502
ZINC000009303506
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