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

Systemtic Name: 4-methoxy-N-phenyl-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide Openeye Name: 4-methoxy-N-phenyl-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide CAS Name: 4-methoxy-N-phenyl-3-[5-[(2-phenyl-1-azepanyl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide IUPAC Name: 4-methoxy-N-phenyl-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide Traditional Name: 4-methoxy-N-phenyl-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]benzenesulfonamide Formula: C30H33N3O3S MolecularWeight: 515.66632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2)C3=CC=C(N3)CN4CCCCCC4C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2)C3=CC=C(N3)CN4CCCCCC4C5=CC=CC=C5

InChI

InChI=1S/C30H33N3O3S/c1-36-30-19-17-26(37(34,35)32-24-13-7-3-8-14-24)21-27(30)28-18-16-25(31-28)22-33-20-10-4-9-15-29(33)23-11-5-2-6-12-23/h2-3,5-8,11-14,16-19,21,29,31-32H,4,9-10,15,20,22H2,1H3