2-[5-[(4-nitrophenyl)methylsulfonyl]-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-yl]ethanamine

Systemtic Name: 2-[5-[(4-nitrophenyl)methylsulfonyl]-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-yl]ethanamine Openeye Name: 2-[4-(4-benzyloxyphenyl)-5-[(4-nitrophenyl)methylsulfonyl]-1,2,4-triazol-3-yl]ethanamine CAS Name: 2-[5-[(4-nitrophenyl)methylsulfonyl]-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-yl]ethanamine IUPAC Name: 2-[5-[(4-nitrophenyl)methylsulfonyl]-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-yl]ethanamine Traditional Name: 2-[4-(4-benzoxyphenyl)-5-(4-nitrobenzyl)sulfonyl-1,2,4-triazol-3-yl]ethylamine Formula: C24H23N5O5S MolecularWeight: 493.53492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)N3C(=NN=C3S(=O)(=O)CC4=CC=C(C=C4)[N+](=O)[O-])CCN

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)N3C(=NN=C3S(=O)(=O)CC4=CC=C(C=C4)[N+](=O)[O-])CCN

InChI

InChI=1S/C24H23N5O5S/c25-15-14-23-26-27-24(35(32,33)17-19-6-8-21(9-7-19)29(30)31)28(23)20-10-12-22(13-11-20)34-16-18-4-2-1-3-5-18/h1-13H,14-17,25H2