Vitas-M small molecule compound
2-({5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
Catalog ID
STK676257
SMILES O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)N1CCc2c1cccc2)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)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 C40H38N6O3S3 MW 746.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H38N6O3S3/c47-37(41-30-17-20-33-35(23-30)52-40(42-33)51-26-38(48)45-22-21-29-11-7-8-14-34(29)45)25-50-39-44-43-36(46(39)31-12-5-2-6-13-31)24-49-32-18-15-28(16-19-32)27-9-3-1-4-10-27/h2,5-8,11-20,23,27H,1,3-4,9-10,21-22,24-26H2,(H,41,47)InChIKey
NAHAGLKTJUJAHA-UHFFFAOYSA-NSynonyms
2((5((4CYCLOHEXYLPHENOXY)METHYL)4PHENYL124TRIAZOL3YL)SULFANYL)N(2(2(23DIHYDROINDOL1YL)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)ACETAMIDE
2((5((4cyclohexylphenoxy)methyl)4phenyl4H124triazol3yl)sulfanyl)N(2((2(23dihydro1Hindol1yl)2oxoethyl)sulfanyl)13benzothiazol6yl)acetamide
2((5((4cyclohexylphenoxy)methyl)4phenyl4H124triazol3yl)thio)N(2((2(indolin1yl)2oxoethyl)thio)benzo(d)thiazol6yl)acetamide
2(5((4CYCLOHEXYLPHENOXY)METHYL)4PHENYL(124TRIAZOL3YLTHIO))N(2(2INDOLINYL2OXOETHYLTHIO)BENZOTHIAZOL6YL)ACETAMIDE
C1CCC(CC1)C2=CC=C(C=C2)OCC3=NN=C(N3C4=CC=CC=C4)SCC(=O)NC5=CC6=C(C=C5)N=C(S6)SCC(=O)N7CCC8=CC=CC=C87
InChI=1SC40H38N6O3S3c4737(413017203335(2330)5240(4233)512638(48)4522212911781434(29)45)255039444336(46(39)31125261331)244932181528(161932)2793141027h25811202327H13491021222426H2(H4147)
MFCD01872810
ZINC000097999873
ZINC97999873
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