2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(4-ethylphenyl)methyl]propanamide

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(4-ethylphenyl)methyl]propanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(4-ethylphenyl)methyl]propanamide CAS Name: 2-[5-(1-azepanylsulfonyl)-1-indolyl]-N-[(4-ethylphenyl)methyl]propanamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(4-ethylphenyl)methyl]propanamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-(4-ethylbenzyl)propionamide Formula: C26H33N3O3S MolecularWeight: 467.62352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)C(C)N2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)C(C)N2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C26H33N3O3S/c1-3-21-8-10-22(11-9-21)19-27-26(30)20(2)29-17-14-23-18-24(12-13-25(23)29)33(31,32)28-15-6-4-5-7-16-28/h8-14,17-18,20H,3-7,15-16,19H2,1-2H3,(H,27,30)