1-[4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]phenyl]sulfonyl-3,4-dihydro-2H-quinoline

Systemtic Name: 1-[4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]phenyl]sulfonyl-3,4-dihydro-2H-quinoline Openeye Name: 1-[4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]phenyl]sulfonyl-3,4-dihydro-2H-quinoline CAS Name: 1-[4-methoxy-3-[5-[(2-phenyl-1-azepanyl)methyl]-1H-pyrrol-2-yl]phenyl]sulfonyl-3,4-dihydro-2H-quinoline IUPAC Name: 1-[4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]phenyl]sulfonyl-3,4-dihydro-2H-quinoline Traditional Name: 1-[4-methoxy-3-[5-[(2-phenylazepan-1-yl)methyl]-1H-pyrrol-2-yl]phenyl]sulfonyl-3,4-dihydro-2H-quinoline Formula: C33H37N3O3S MolecularWeight: 555.73018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC3=CC=CC=C32)C4=CC=C(N4)CN5CCCCCC5C6=CC=CC=C6

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC3=CC=CC=C32)C4=CC=C(N4)CN5CCCCCC5C6=CC=CC=C6

InChI

InChI=1S/C33H37N3O3S/c1-39-33-20-18-28(40(37,38)36-22-10-14-26-13-7-8-16-32(26)36)23-29(33)30-19-17-27(34-30)24-35-21-9-3-6-15-31(35)25-11-4-2-5-12-25/h2,4-5,7-8,11-13,16-20,23,31,34H,3,6,9-10,14-15,21-22,24H2,1H3