N-[[4-cyclohexyl-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-methoxy-aniline

Systemtic Name: N-[[4-cyclohexyl-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-methoxy-aniline Openeye Name: N-[[4-cyclohexyl-5-[(5-phenylisoxazol-3-yl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-methoxy-aniline CAS Name: N-[[4-cyclohexyl-5-[(5-phenyl-3-isoxazolyl)methylthio]-1,2,4-triazol-3-yl]methyl]-3-methoxyaniline IUPAC Name: N-[[4-cyclohexyl-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-methoxyaniline Traditional Name: [4-cyclohexyl-5-[(5-phenylisoxazol-3-yl)methylthio]-1,2,4-triazol-3-yl]methyl-(3-methoxyphenyl)amine Formula: C26H29N5O2S MolecularWeight: 475.60576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NCC2=NN=C(N2C3CCCCC3)SCC4=NOC(=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)NCC2=NN=C(N2C3CCCCC3)SCC4=NOC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H29N5O2S/c1-32-23-14-8-11-20(15-23)27-17-25-28-29-26(31(25)22-12-6-3-7-13-22)34-18-21-16-24(33-30-21)19-9-4-2-5-10-19/h2,4-5,8-11,14-16,22,27H,3,6-7,12-13,17-18H2,1H3