N-[(4-cyclohexyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]-3-methoxy-aniline

Systemtic Name: N-[(4-cyclohexyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]-3-methoxy-aniline Openeye Name: N-[(4-cyclohexyl-5-isopropylsulfanyl-1,2,4-triazol-3-yl)methyl]-3-methoxy-aniline CAS Name: N-[[4-cyclohexyl-5-(propan-2-ylthio)-1,2,4-triazol-3-yl]methyl]-3-methoxyaniline IUPAC Name: N-[(4-cyclohexyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]-3-methoxyaniline Traditional Name: [4-cyclohexyl-5-(isopropylthio)-1,2,4-triazol-3-yl]methyl-(3-methoxyphenyl)amine Formula: C19H28N4OS MolecularWeight: 360.51682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(N1C2CCCCC2)CNC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)SC1=NN=C(N1C2CCCCC2)CNC3=CC(=CC=C3)OC

InChI

InChI=1S/C19H28N4OS/c1-14(2)25-19-22-21-18(23(19)16-9-5-4-6-10-16)13-20-15-8-7-11-17(12-15)24-3/h7-8,11-12,14,16,20H,4-6,9-10,13H2,1-3H3