Vitas-M small molecule compound
N-(1,3-benzothiazol-2-yl)-2-({5-[(2,6-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK118001
SMILES O=C(Nc1nc2c(s1)cccc2)CSc1nnc(n1C)COc1c(C)cccc1C
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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 C21H21N5O2S2 MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S2/c1-13-7-6-8-14(2)19(13)28-11-17-24-25-21(26(17)3)29-12-18(27)23-20-22-15-9-4-5-10-16(15)30-20/h4-10H,11-12H2,1-3H3,(H,22,23,27)InChIKey
FKKRWJZUNHAPRA-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)C)OCC2=NN=C(N2C)SCC(=O)NC3=NC4=CC=CC=C4S3
InChI=1SC21H21N5O2S2c11376814(2)19(13)281117242521(26(17)3)291218(27)232022159451016(15)3020h410H1112H213H3(H222327)
MFCD04127789
N(13BENZOTHIAZOL2YL)2((5((26DIMETHYLPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13BENZOTHIAZOL2YL)2((5((26DIMETHYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001131872
ZINC01131872
ZINC1131872
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