(E)-2-[1-[[1-(phenylmethyl)pyrrolidin-3-yl]methyl]indol-5-yl]ethenesulfonamide

Systemtic Name: (E)-2-[1-[[1-(phenylmethyl)pyrrolidin-3-yl]methyl]indol-5-yl]ethenesulfonamide Openeye Name: (E)-2-[1-[(1-benzylpyrrolidin-3-yl)methyl]indol-5-yl]ethenesulfonamide CAS Name: (E)-2-[1-[[1-(phenylmethyl)-3-pyrrolidinyl]methyl]-5-indolyl]ethenesulfonamide IUPAC Name: (E)-2-[1-[(1-benzylpyrrolidin-3-yl)methyl]indol-5-yl]ethenesulfonamide Traditional Name: (E)-2-[1-[(1-benzylpyrrolidin-3-yl)methyl]indol-5-yl]ethenesulfonamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1CN2C=CC3=C2C=CC(=C3)C=CS(=O)(=O)N)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC1CN2C=CC3=C2C=CC(=C3)/C=C/S(=O)(=O)N)CC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O2S/c23-28(26,27)13-10-18-6-7-22-21(14-18)9-12-25(22)17-20-8-11-24(16-20)15-19-4-2-1-3-5-19/h1-7,9-10,12-14,20H,8,11,15-17H2,(H2,23,26,27)/b13-10+