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

Systemtic Name: 4-chloranyl-N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]aniline Openeye Name: 4-chloro-N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]aniline CAS Name: 4-chloro-N-[[5-(ethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline IUPAC Name: 4-chloro-N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]aniline Traditional Name: (4-chlorophenyl)-[[5-(ethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]amine Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=CC=C2)CNC3=CC=C(C=C3)Cl

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=CC=C2)CNC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17ClN4S/c1-2-23-17-21-20-16(22(17)15-6-4-3-5-7-15)12-19-14-10-8-13(18)9-11-14/h3-11,19H,2,12H2,1H3