N-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]pyridine-3-sulfonamide

Systemtic Name: N-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]pyridine-3-sulfonamide Openeye Name: N-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxo-propyl]pyridine-3-sulfonamide CAS Name: N-[3-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-3-oxopropyl]-3-pyridinesulfonamide IUPAC Name: N-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxopropyl]pyridine-3-sulfonamide Traditional Name: N-[3-[4-(2,5-dimethoxybenzyl)piperazino]-3-keto-propyl]pyridine-3-sulfonamide Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O5S/c1-29-18-5-6-20(30-2)17(14-18)16-24-10-12-25(13-11-24)21(26)7-9-23-31(27,28)19-4-3-8-22-15-19/h3-6,8,14-15,23H,7,9-13,16H2,1-2H3