1-[[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-[[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-[[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[[5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[[5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-[[5-(5-esyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinoline Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=C(N2)CC3C4=CC=CC=C4CCN3

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=C(N2)CC3C4=CC=CC=C4CCN3

InChI

InChI=1S/C23H26N2O3S/c1-3-29(26,27)18-9-11-23(28-2)20(15-18)21-10-8-17(25-21)14-22-19-7-5-4-6-16(19)12-13-24-22/h4-11,15,22,24-25H,3,12-14H2,1-2H3