2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(2-ethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(2-ethoxyphenyl)methyl]ethanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(2-ethoxyphenyl)methyl]acetamide CAS Name: 2-[5-(1-azepanylsulfonyl)-1-indolyl]-N-[(2-ethoxyphenyl)methyl]acetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(2-ethoxyphenyl)methyl]acetamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-(2-ethoxybenzyl)acetamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CNC(=O)CN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCOC1=CC=CC=C1CNC(=O)CN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O4S/c1-2-32-24-10-6-5-9-21(24)18-26-25(29)19-27-16-13-20-17-22(11-12-23(20)27)33(30,31)28-14-7-3-4-8-15-28/h5-6,9-13,16-17H,2-4,7-8,14-15,18-19H2,1H3,(H,26,29)