N-(2,6-diethylphenyl)-2-[4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[4-[2-(1-naphthyl)ethylsulfonyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-(2,6-diethylphenyl)-2-[4-[2-(1-naphthalenyl)ethylsulfonyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-(2,6-diethylphenyl)-2-[4-[2-(1-naphthyl)ethylsulfonyl]-1,4-diazepan-1-yl]acetamide Formula: C29H37N3O3S MolecularWeight: 507.68738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)S(=O)(=O)CCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)S(=O)(=O)CCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C29H37N3O3S/c1-3-23-11-7-12-24(4-2)29(23)30-28(33)22-31-17-9-18-32(20-19-31)36(34,35)21-16-26-14-8-13-25-10-5-6-15-27(25)26/h5-8,10-15H,3-4,9,16-22H2,1-2H3,(H,30,33)