Vitas-M small molecule compound
2-{[5-benzyl-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(morpholin-4-yl)phenyl]acetamide
Catalog ID
STL381595
SMILES O=C(Nc1ccc(cc1)N1CCOCC1)CSc1nnc(n1c1ccc(cc1)Cl)Cc1ccccc1
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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 C27H26ClN5O2S MW 520.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN5O2S/c28-21-6-10-24(11-7-21)33-25(18-20-4-2-1-3-5-20)30-31-27(33)36-19-26(34)29-22-8-12-23(13-9-22)32-14-16-35-17-15-32/h1-13H,14-19H2,(H,29,34)InChIKey
LOHDTQFAYCIVSF-UHFFFAOYSA-NSynonyms
2((5BENZYL4(4CHLOROPHENYL)124TRIAZOL3YL)SULFANYL)N(4MORPHOLIN4YLPHENYL)ACETAMIDE
2((5benzyl4(4chlorophenyl)4H124triazol3yl)sulfanyl)N(4(morpholin4yl)phenyl)acetamide
C1COCCN1C2=CC=C(C=C2)NC(=O)CSC3=NN=C(N3C4=CC=C(C=C4)Cl)CC5=CC=CC=C5
InChI=1SC27H26ClN5O2Sc282161024(11721)3325(18204213520)303127(33)361926(34)292281223(13922)32141635171532h113H1419H2(H2934)
MFCD06631663
ZINC000001069774
ZINC01069774
ZINC1069774
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