(1-naphthalen-2-ylsulfonylpiperidin-3-yl)-(4-pyridin-4-ylpiperazin-1-yl)methanone

Systemtic Name: (1-naphthalen-2-ylsulfonylpiperidin-3-yl)-(4-pyridin-4-ylpiperazin-1-yl)methanone Openeye Name: [1-(2-naphthylsulfonyl)-3-piperidyl]-[4-(4-pyridyl)piperazin-1-yl]methanone CAS Name: [1-(2-naphthalenylsulfonyl)-3-piperidinyl]-(4-pyridin-4-yl-1-piperazinyl)methanone IUPAC Name: (1-naphthalen-2-ylsulfonylpiperidin-3-yl)-(4-pyridin-4-ylpiperazin-1-yl)methanone Traditional Name: [1-(2-naphthylsulfonyl)-3-piperidyl]-[4-(4-pyridyl)piperazino]methanone Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)N4CCN(CC4)C5=CC=NC=C5

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)N4CCN(CC4)C5=CC=NC=C5

InChI

InChI=1S/C25H28N4O3S/c30-25(28-16-14-27(15-17-28)23-9-11-26-12-10-23)22-6-3-13-29(19-22)33(31,32)24-8-7-20-4-1-2-5-21(20)18-24/h1-2,4-5,7-12,18,22H,3,6,13-17,19H2