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

Systemtic Name: 2-[3-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]ethanamine Openeye Name: 2-(3-benzylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)ethanamine CAS Name: 2-[3-phenyl-5-(phenylmethylthio)-1,2,4-triazol-4-yl]ethanamine IUPAC Name: 2-(3-benzylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)ethanamine Traditional Name: 2-[3-(benzylthio)-5-phenyl-1,2,4-triazol-4-yl]ethylamine Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(N2CCN)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2CCN)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4S/c18-11-12-21-16(15-9-5-2-6-10-15)19-20-17(21)22-13-14-7-3-1-4-8-14/h1-10H,11-13,18H2