4-(phenylmethyl)-3-[(2-phenylphenyl)methylsulfonyl]-5-pyrrolidin-2-yl-1,2,4-triazole

Systemtic Name: 4-(phenylmethyl)-3-[(2-phenylphenyl)methylsulfonyl]-5-pyrrolidin-2-yl-1,2,4-triazole Openeye Name: 4-benzyl-3-[(2-phenylphenyl)methylsulfonyl]-5-pyrrolidin-2-yl-1,2,4-triazole CAS Name: 4-(phenylmethyl)-3-[(2-phenylphenyl)methylsulfonyl]-5-(2-pyrrolidinyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-[(2-phenylphenyl)methylsulfonyl]-5-pyrrolidin-2-yl-1,2,4-triazole Traditional Name: 4-benzyl-3-(2-phenylbenzyl)sulfonyl-5-pyrrolidin-2-yl-1,2,4-triazole Formula: C26H26N4O2S MolecularWeight: 458.57524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C2=NN=C(N2CC3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1CC(NC1)C2=NN=C(N2CC3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C26H26N4O2S/c31-33(32,19-22-14-7-8-15-23(22)21-12-5-2-6-13-21)26-29-28-25(24-16-9-17-27-24)30(26)18-20-10-3-1-4-11-20/h1-8,10-15,24,27H,9,16-19H2