Vitas-M small molecule compound
2-{[4-methyl-5-(naphthalen-1-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
Catalog ID
STK675304
SMILES O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)N1CCOCC1)CSc1nnc(n1C)Cc1cccc2c1cccc2
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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 C29H28N6O3S3 MW 604.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N6O3S3/c1-34-25(15-20-7-4-6-19-5-2-3-8-22(19)20)32-33-28(34)39-17-26(36)30-21-9-10-23-24(16-21)41-29(31-23)40-18-27(37)35-11-13-38-14-12-35/h2-10,16H,11-15,17-18H2,1H3,(H,30,36)InChIKey
IQRACBCEOOZONR-UHFFFAOYSA-NSynonyms
2((4METHYL5(NAPHTHALEN1YLMETHYL)124TRIAZOL3YL)SULFANYL)N(2(2MORPHOLIN4YL2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)ACETAMIDE
2((4methyl5(naphthalen1ylmethyl)4H124triazol3yl)sulfanyl)N(2((2(morpholin4yl)2oxoethyl)sulfanyl)13benzothiazol6yl)acetamide
CN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)N4CCOCC4)CC5=CC=CC6=CC=CC=C65
InChI=1SC29H28N6O3S3c13425(152074619523822(19)20)323328(34)391726(36)30219102324(1621)4129(3123)401827(37)35111338141235h21016H11151718H21H3(H3036)
MFCD01429499
ZINC000098002705
ZINC98002705
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