Vitas-M small molecule compound
2-{[4-amino-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-dicyclohexylacetamide
Catalog ID
STK114746
SMILES O=C(N(C1CCCCC1)C1CCCCC1)CSc1nnc(n1N)c1ccc(cc1)Cl
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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 C22H30ClN5OS MW 448.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30ClN5OS/c23-17-13-11-16(12-14-17)21-25-26-22(28(21)24)30-15-20(29)27(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h11-14,18-19H,1-10,15,24H2InChIKey
HESQLCIORTYLCJ-UHFFFAOYSA-NSynonyms
2((4AMINO5(4CHLOROPHENYL)124TRIAZOL3YL)SULFANYL)NNDICYCLOHEXYLACETAMIDE
2((4AMINO5(4CHLOROPHENYL)4H124TRIAZOL3YL)SULFANYL)NNDICYCLOHEXYLACETAMIDE
C1CCC(CC1)N(C2CCCCC2)C(=O)CSC3=NN=C(N3N)C4=CC=C(C=C4)Cl
InChI=1SC22H30ClN5OSc2317131116(121417)21252622(28(21)24)301520(29)27(187314818)1995261019h11141819H1101524H2
MFCD03864786
ZINC000002143711
ZINC02143711
ZINC2143711
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