N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-1H-indole-3-carboxamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-1H-indole-3-carboxamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-1H-indole-3-carboxamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-1H-indole-3-carboxamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-1H-indole-3-carboxamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-1H-indole-3-carboxamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H25N3O4S/c1-29-21-11-10-16(30(27,28)25-12-6-2-3-7-13-25)14-20(21)24-22(26)18-15-23-19-9-5-4-8-17(18)19/h4-5,8-11,14-15,23H,2-3,6-7,12-13H2,1H3,(H,24,26)