N,N-bis(phenylmethyl)-6-(propan-2-ylamino)pyridin-1-ium-3-sulfonamide

Systemtic Name: N,N-bis(phenylmethyl)-6-(propan-2-ylamino)pyridin-1-ium-3-sulfonamide Openeye Name: N,N-dibenzyl-6-(isopropylamino)pyridin-1-ium-3-sulfonamide CAS Name: N,N-bis(phenylmethyl)-6-(propan-2-ylamino)-3-pyridin-1-iumsulfonamide IUPAC Name: N,N-dibenzyl-6-(propan-2-ylamino)pyridin-1-ium-3-sulfonamide Traditional Name: N,N-dibenzyl-6-(isopropylamino)pyridin-1-ium-3-sulfonamide Formula: C22H26N3O2S+ MolecularWeight: 396.52574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=[NH+]C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)NC1=[NH+]C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2S/c1-18(2)24-22-14-13-21(15-23-22)28(26,27)25(16-19-9-5-3-6-10-19)17-20-11-7-4-8-12-20/h3-15,18H,16-17H2,1-2H3,(H,23,24)/p+1