1-[(6-methylpyridin-2-yl)methyl]-4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepane

Systemtic Name: 1-[(6-methylpyridin-2-yl)methyl]-4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepane Openeye Name: 1-[(6-methyl-2-pyridyl)methyl]-4-[2-(1-naphthyl)ethylsulfonyl]-1,4-diazepane CAS Name: 1-[(6-methyl-2-pyridinyl)methyl]-4-[2-(1-naphthalenyl)ethylsulfonyl]-1,4-diazepane IUPAC Name: 1-[(6-methylpyridin-2-yl)methyl]-4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepane Traditional Name: 1-[(6-methyl-2-pyridyl)methyl]-4-[2-(1-naphthyl)ethylsulfonyl]-1,4-diazepane Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCN(CC2)S(=O)(=O)CCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCN(CC2)S(=O)(=O)CCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H29N3O2S/c1-20-7-4-11-23(25-20)19-26-14-6-15-27(17-16-26)30(28,29)18-13-22-10-5-9-21-8-2-3-12-24(21)22/h2-5,7-12H,6,13-19H2,1H3