3-(3-azanylidene-1H-isoindol-2-yl)-N-(4-methoxyphenyl)-4-piperidin-1-yl-benzenesulfonamide

Systemtic Name: 3-(3-azanylidene-1H-isoindol-2-yl)-N-(4-methoxyphenyl)-4-piperidin-1-yl-benzenesulfonamide Openeye Name: 3-(1-iminoisoindolin-2-yl)-N-(4-methoxyphenyl)-4-(1-piperidyl)benzenesulfonamide CAS Name: 3-(3-imino-1H-isoindol-2-yl)-N-(4-methoxyphenyl)-4-(1-piperidinyl)benzenesulfonamide IUPAC Name: 3-(3-imino-1H-isoindol-2-yl)-N-(4-methoxyphenyl)-4-piperidin-1-ylbenzenesulfonamide Traditional Name: 3-(1-iminoisoindolin-2-yl)-N-(4-methoxyphenyl)-4-piperidino-benzenesulfonamide Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCCC3)N4CC5=CC=CC=C5C4=N

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCCC3)N4CC5=CC=CC=C5C4=N

InChI

InChI=1S/C26H28N4O3S/c1-33-21-11-9-20(10-12-21)28-34(31,32)22-13-14-24(29-15-5-2-6-16-29)25(17-22)30-18-19-7-3-4-8-23(19)26(30)27/h3-4,7-14,17,27-28H,2,5-6,15-16,18H2,1H3