N-[[5-[2-(dicyclohexylamino)-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide

Systemtic Name: N-[[5-[2-(dicyclohexylamino)-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide Openeye Name: N-[[5-[2-(dicyclohexylamino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide CAS Name: N-[[5-[[2-(dicyclohexylamino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methylbenzamide IUPAC Name: N-[[5-[2-(dicyclohexylamino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methylbenzamide Traditional Name: N-[[5-[[2-(dicyclohexylamino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide Formula: C26H37N5O2S MolecularWeight: 483.66928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC2=NN=C(N2C)SCC(=O)N(C3CCCCC3)C4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC2=NN=C(N2C)SCC(=O)N(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C26H37N5O2S/c1-19-11-9-10-16-22(19)25(33)27-17-23-28-29-26(30(23)2)34-18-24(32)31(20-12-5-3-6-13-20)21-14-7-4-8-15-21/h9-11,16,20-21H,3-8,12-15,17-18H2,1-2H3,(H,27,33)