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

Systemtic Name: 4-[4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]aniline Openeye Name: 4-(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)aniline CAS Name: 4-[4-phenyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]aniline IUPAC Name: 4-(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)aniline Traditional Name: [4-[5-(benzylthio)-4-phenyl-1,2,4-triazol-3-yl]phenyl]amine Formula: C21H18N4S MolecularWeight: 358.45942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)N

InChI

InChI=1S/C21H18N4S/c22-18-13-11-17(12-14-18)20-23-24-21(25(20)19-9-5-2-6-10-19)26-15-16-7-3-1-4-8-16/h1-14H,15,22H2