N-[3-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]naphthalene-2-sulfonamide Openeye Name: N-[3-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxo-propyl]naphthalene-2-sulfonamide CAS Name: N-[3-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]-3-oxopropyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxopropyl]naphthalene-2-sulfonamide Traditional Name: N-[3-keto-3-(4-veratrylpiperazino)propyl]naphthalene-2-sulfonamide Formula: C26H31N3O5S MolecularWeight: 497.60644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C26H31N3O5S/c1-33-24-10-7-20(17-25(24)34-2)19-28-13-15-29(16-14-28)26(30)11-12-27-35(31,32)23-9-8-21-5-3-4-6-22(21)18-23/h3-10,17-18,27H,11-16,19H2,1-2H3