4-(6-chloranylnaphthalen-2-yl)sulfonyl-4-[(2-oxidanylidenepiperazin-1-yl)methyl]-1-pyridin-4-yl-piperidine-2-carbaldehyde

Systemtic Name: 4-(6-chloranylnaphthalen-2-yl)sulfonyl-4-[(2-oxidanylidenepiperazin-1-yl)methyl]-1-pyridin-4-yl-piperidine-2-carbaldehyde Openeye Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-4-[(2-oxopiperazin-1-yl)methyl]-1-(4-pyridyl)piperidine-2-carbaldehyde CAS Name: 4-[(6-chloro-2-naphthalenyl)sulfonyl]-4-[(2-oxo-1-piperazinyl)methyl]-1-pyridin-4-yl-2-piperidinecarboxaldehyde IUPAC Name: 4-(6-chloronaphthalen-2-yl)sulfonyl-4-[(2-oxopiperazin-1-yl)methyl]-1-pyridin-4-ylpiperidine-2-carbaldehyde Traditional Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-4-[(2-ketopiperazino)methyl]-1-(4-pyridyl)pipecolinaldehyde Formula: C26H27ClN4O4S MolecularWeight: 527.03498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1(CN2CCNCC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C=O)C5=CC=NC=C5

Isomeric SMILES

C1CN(C(CC1(CN2CCNCC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C=O)C5=CC=NC=C5

InChI

InChI=1S/C26H27ClN4O4S/c27-21-3-1-20-14-24(4-2-19(20)13-21)36(34,35)26(18-30-12-10-29-16-25(30)33)7-11-31(23(15-26)17-32)22-5-8-28-9-6-22/h1-6,8-9,13-14,17,23,29H,7,10-12,15-16,18H2