4-chloranyl-N-[[4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]aniline

Systemtic Name: 4-chloranyl-N-[[4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]aniline Openeye Name: N-[(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-4-chloro-aniline CAS Name: 4-chloro-N-[[4-phenyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]aniline IUPAC Name: N-[(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-4-chloroaniline Traditional Name: [5-(benzylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl-(4-chlorophenyl)amine Formula: C22H19ClN4S MolecularWeight: 406.93106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H19ClN4S/c23-18-11-13-19(14-12-18)24-15-21-25-26-22(27(21)20-9-5-2-6-10-20)28-16-17-7-3-1-4-8-17/h1-14,24H,15-16H2