2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(4-dimethylaminophenyl)methyl]ethanamide

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(4-dimethylaminophenyl)methyl]ethanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(4-dimethylaminophenyl)methyl]acetamide CAS Name: 2-[5-(1-azepanylsulfonyl)-1-indolyl]-N-[(4-dimethylaminophenyl)methyl]acetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(4-dimethylaminophenyl)methyl]acetamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[4-(dimethylamino)benzyl]acetamide Formula: C25H32N4O3S MolecularWeight: 468.61158

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)CN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)CN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H32N4O3S/c1-27(2)22-9-7-20(8-10-22)18-26-25(30)19-28-16-13-21-17-23(11-12-24(21)28)33(31,32)29-14-5-3-4-6-15-29/h7-13,16-17H,3-6,14-15,18-19H2,1-2H3,(H,26,30)