[4-(6-bromanylnaphthalen-2-yl)sulfanylphenyl]-(1-pyridin-4-ylpiperidin-4-yl)methanone

Systemtic Name: [4-(6-bromanylnaphthalen-2-yl)sulfanylphenyl]-(1-pyridin-4-ylpiperidin-4-yl)methanone Openeye Name: [4-[(6-bromo-2-naphthyl)sulfanyl]phenyl]-[1-(4-pyridyl)-4-piperidyl]methanone CAS Name: [4-[(6-bromo-2-naphthalenyl)thio]phenyl]-(1-pyridin-4-yl-4-piperidinyl)methanone IUPAC Name: [4-(6-bromonaphthalen-2-yl)sulfanylphenyl]-(1-pyridin-4-ylpiperidin-4-yl)methanone Traditional Name: [4-[(6-bromo-2-naphthyl)thio]phenyl]-[1-(4-pyridyl)-4-piperidyl]methanone Formula: C27H23BrN2OS MolecularWeight: 503.45332

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)SC3=CC4=C(C=C3)C=C(C=C4)Br)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)SC3=CC4=C(C=C3)C=C(C=C4)Br)C5=CC=NC=C5

InChI

InChI=1S/C27H23BrN2OS/c28-23-5-1-22-18-26(8-4-21(22)17-23)32-25-6-2-19(3-7-25)27(31)20-11-15-30(16-12-20)24-9-13-29-14-10-24/h1-10,13-14,17-18,20H,11-12,15-16H2