4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide

Systemtic Name: 4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide Openeye Name: 4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide CAS Name: 4-methoxy-3-[5-[(2-phenyl-1-azepanyl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide IUPAC Name: 4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide Traditional Name: 4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C2=CC=C(N2)CN3CCCCCC3C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C2=CC=C(N2)CN3CCCCCC3C4=CC=CC=C4

InChI

InChI=1S/C24H29N3O3S/c1-30-24-14-12-20(31(25,28)29)16-21(24)22-13-11-19(26-22)17-27-15-7-3-6-10-23(27)18-8-4-2-5-9-18/h2,4-5,8-9,11-14,16,23,26H,3,6-7,10,15,17H2,1H3,(H2,25,28,29)