5-methyl-3-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]-1-(3-phenylpropyl)-1,2,4-triazole

Systemtic Name: 5-methyl-3-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]-1-(3-phenylpropyl)-1,2,4-triazole Openeye Name: 3-(1-benzylsulfonylpyrrolidin-2-yl)-5-methyl-1-(3-phenylpropyl)-1,2,4-triazole CAS Name: 5-methyl-3-[1-(phenylmethyl)sulfonyl-2-pyrrolidinyl]-1-(3-phenylpropyl)-1,2,4-triazole IUPAC Name: 3-(1-benzylsulfonylpyrrolidin-2-yl)-5-methyl-1-(3-phenylpropyl)-1,2,4-triazole Traditional Name: 3-(1-benzylsulfonylpyrrolidin-2-yl)-5-methyl-1-(3-phenylpropyl)-1,2,4-triazole Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1CCCC2=CC=CC=C2)C3CCCN3S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=NN1CCCC2=CC=CC=C2)C3CCCN3S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2S/c1-19-24-23(25-26(19)16-8-14-20-10-4-2-5-11-20)22-15-9-17-27(22)30(28,29)18-21-12-6-3-7-13-21/h2-7,10-13,22H,8-9,14-18H2,1H3