N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-(1H-indol-3-yl)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-(1H-indol-3-yl)ethanamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-2-(1H-indol-3-yl)acetamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-2-(1H-indol-3-yl)acetamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-2-(1H-indol-3-yl)acetamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-2-(1H-indol-3-yl)acetamide Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CC4=CNC5=CC=CC=C54

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CC4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H32N4O4S/c31-26(17-20-19-27-23-8-4-3-7-22(20)23)28-24-18-21(35(32,33)30-13-15-34-16-14-30)9-10-25(24)29-11-5-1-2-6-12-29/h3-4,7-10,18-19,27H,1-2,5-6,11-17H2,(H,28,31)