Vitas-M small molecule compound
N-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL055162
SMILES CCCCNC(=O)CSc1nc2c(s1)cc(cc2)NC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1
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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 C29H28N6O2S3 MW 588.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N6O2S3/c1-2-3-16-30-25(36)18-39-29-32-23-15-14-21(17-24(23)40-29)31-26(37)19-38-28-34-33-27(20-10-6-4-7-11-20)35(28)22-12-8-5-9-13-22/h4-15,17H,2-3,16,18-19H2,1H3,(H,30,36)(H,31,37)InChIKey
UBFAVJXQPBRUOY-UHFFFAOYSA-NSynonyms
CCCCNC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC29H28N6O2S3c123163025(36)1839293223151421(1724(23)4029)3126(37)193828343327(20106471120)35(28)22128591322h41517H23161819H21H3(H3036)(H3137)
MFCD03082307
N(2((2(butylamino)2oxoethyl)sulfanyl)13benzothiazol6yl)2((45diphenyl4H124triazol3yl)sulfanyl)acetamide
N(2(2(BUTYLAMINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)2((45DIPHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
Nbutyl2((6(2((45diphenyl4H124triazol3yl)thio)acetamido)benzo(d)thiazol2yl)thio)acetamide
ZINC000008437968
ZINC08437968
ZINC8437968
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