N-[[4-(3-bromanyl-5-methoxy-phenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]methyl]-4-imidazol-1-yl-benzenesulfonamide

Systemtic Name: N-[[4-(3-bromanyl-5-methoxy-phenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]methyl]-4-imidazol-1-yl-benzenesulfonamide Openeye Name: N-[[4-(3-bromo-5-methoxy-phenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]methyl]-4-imidazol-1-yl-benzenesulfonamide CAS Name: N-[[4-(3-bromo-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-2-piperazinyl]methyl]-4-(1-imidazolyl)benzenesulfonamide IUPAC Name: N-[[4-(3-bromo-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]methyl]-4-imidazol-1-ylbenzenesulfonamide Traditional Name: N-[[4-(3-bromo-5-methoxy-phenyl)-1-veratryl-piperazin-2-yl]methyl]-4-imidazol-1-yl-benzenesulfonamide Formula: C30H34BrN5O5S MolecularWeight: 656.59046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2CNS(=O)(=O)C3=CC=C(C=C3)N4C=CN=C4)C5=CC(=CC(=C5)Br)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2CNS(=O)(=O)C3=CC=C(C=C3)N4C=CN=C4)C5=CC(=CC(=C5)Br)OC)OC

InChI

InChI=1S/C30H34BrN5O5S/c1-39-27-16-23(31)15-25(17-27)35-13-12-34(19-22-4-9-29(40-2)30(14-22)41-3)26(20-35)18-33-42(37,38)28-7-5-24(6-8-28)36-11-10-32-21-36/h4-11,14-17,21,26,33H,12-13,18-20H2,1-3H3