Vitas-M small molecule compound
N-(2-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-({4-methyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STL042289
SMILES O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)NC1CC1)CSc1nnc(n1C)COc1ccccc1C
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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 C25H26N6O3S3 MW 554.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N6O3S3/c1-15-5-3-4-6-19(15)34-12-21-29-30-24(31(21)2)35-13-22(32)27-17-9-10-18-20(11-17)37-25(28-18)36-14-23(33)26-16-7-8-16/h3-6,9-11,16H,7-8,12-14H2,1-2H3,(H,26,33)(H,27,32)InChIKey
NFCMJFKSAGFSSZ-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1OCC2=NN=C(N2C)SCC(=O)NC3=CC4=C(C=C3)N=C(S4)SCC(=O)NC5CC5
InChI=1SC25H26N6O3S3c115534619(15)341221293024(31(21)2)351322(32)27179101820(1117)3725(2818)361423(33)26167816h3691116H781214H212H3(H2633)(H2732)
MFCD03082297
N(2((2(cyclopropylamino)2oxoethyl)sulfanyl)13benzothiazol6yl)2((4methyl5((2methylphenoxy)methyl)4H124triazol3yl)sulfanyl)acetamide
N(2(2(CYCLOPROPYLAMINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)2((4METHYL5((2METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
Ncyclopropyl2((6(2((4methyl5((otolyloxy)methyl)4H124triazol3yl)thio)acetamido)benzo(d)thiazol2yl)thio)acetamide
ZINC000098000342
ZINC98000342
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