N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-indole-2-carboxamide

Systemtic Name: N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-indole-2-carboxamide Openeye Name: N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-indole-2-carboxamide CAS Name: N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-indole-2-carboxamide IUPAC Name: N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-indole-2-carboxamide Traditional Name: N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-indole-2-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

C1CCC(=NCC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C21H22N4O3S/c26-21(19-13-15-7-3-4-10-18(15)24-19)23-16-8-6-9-17(14-16)29(27,28)25-20-11-2-1-5-12-22-20/h3-4,6-10,13-14,24H,1-2,5,11-12H2,(H,22,25)(H,23,26)