N-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-1,4-bis(oxidanylidene)naphthalen-2-yl]thiophene-2-sulfonamide

Systemtic Name: N-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-1,4-bis(oxidanylidene)naphthalen-2-yl]thiophene-2-sulfonamide Openeye Name: N-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-1,4-dioxo-2-naphthyl]thiophene-2-sulfonamide CAS Name: N-[3-[4-(2-ethoxyphenyl)-1-piperazinyl]-1,4-dioxo-2-naphthalenyl]-2-thiophenesulfonamide IUPAC Name: N-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-1,4-dioxonaphthalen-2-yl]thiophene-2-sulfonamide Traditional Name: N-[1,4-diketo-3-(4-o-phenetylpiperazino)-2-naphthyl]thiophene-2-sulfonamide Formula: C26H25N3O5S2 MolecularWeight: 523.6238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C3=C(C(=O)C4=CC=CC=C4C3=O)NS(=O)(=O)C5=CC=CS5

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C3=C(C(=O)C4=CC=CC=C4C3=O)NS(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C26H25N3O5S2/c1-2-34-21-11-6-5-10-20(21)28-13-15-29(16-14-28)24-23(27-36(32,33)22-12-7-17-35-22)25(30)18-8-3-4-9-19(18)26(24)31/h3-12,17,27H,2,13-16H2,1H3