N-[2-azanyl-6-methyl-1,3-bis(oxidanylidene)-1-(3-pyridin-2-ylphenyl)heptan-4-yl]naphthalene-2-sulfonamide

Systemtic Name: N-[2-azanyl-6-methyl-1,3-bis(oxidanylidene)-1-(3-pyridin-2-ylphenyl)heptan-4-yl]naphthalene-2-sulfonamide Openeye Name: N-[3-amino-1-isobutyl-2,4-dioxo-4-[3-(2-pyridyl)phenyl]butyl]naphthalene-2-sulfonamide CAS Name: N-[2-amino-6-methyl-1,3-dioxo-1-[3-(2-pyridinyl)phenyl]heptan-4-yl]-2-naphthalenesulfonamide IUPAC Name: N-[2-amino-6-methyl-1,3-dioxo-1-(3-pyridin-2-ylphenyl)heptan-4-yl]naphthalene-2-sulfonamide Traditional Name: N-[3-amino-1-isobutyl-2,4-diketo-4-[3-(2-pyridyl)phenyl]butyl]naphthalene-2-sulfonamide Formula: C29H29N3O4S MolecularWeight: 515.62326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C(C(=O)C1=CC=CC(=C1)C2=CC=CC=N2)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)CC(C(=O)C(C(=O)C1=CC=CC(=C1)C2=CC=CC=N2)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H29N3O4S/c1-19(2)16-26(32-37(35,36)24-14-13-20-8-3-4-9-21(20)18-24)29(34)27(30)28(33)23-11-7-10-22(17-23)25-12-5-6-15-31-25/h3-15,17-19,26-27,32H,16,30H2,1-2H3