Vitas-M small molecule compound
2-{[5-benzyl-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide
Catalog ID
STL381589
SMILES O=C(NC1CCCCC1)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 C23H25ClN4OS MW 441.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN4OS/c24-18-11-13-20(14-12-18)28-21(15-17-7-3-1-4-8-17)26-27-23(28)30-16-22(29)25-19-9-5-2-6-10-19/h1,3-4,7-8,11-14,19H,2,5-6,9-10,15-16H2,(H,25,29)InChIKey
XDMDWOWRXQLNLU-UHFFFAOYSA-NSynonyms
2((5BENZYL4(4CHLOROPHENYL)124TRIAZOL3YL)SULFANYL)NCYCLOHEXYLACETAMIDE
2((5benzyl4(4chlorophenyl)4H124triazol3yl)sulfanyl)Ncyclohexylacetamide
C1CCC(CC1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)CC4=CC=CC=C4
InChI=1SC23H25ClN4OSc2418111320(141218)2821(15177314817)262723(28)301622(29)251995261019h13478111419H2569101516H2(H2529)
MFCD06005781
ZINC000002875654
ZINC02875654
ZINC2875654
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