[4-(6-bromanylnaphthalen-2-yl)sulfonylpiperazin-1-yl]-[4-(2-isocyanopyridin-4-yl)phenyl]methanone

Systemtic Name: [4-(6-bromanylnaphthalen-2-yl)sulfonylpiperazin-1-yl]-[4-(2-isocyanopyridin-4-yl)phenyl]methanone Openeye Name: [4-[(6-bromo-2-naphthyl)sulfonyl]piperazin-1-yl]-[4-(2-isocyano-4-pyridyl)phenyl]methanone CAS Name: [4-[(6-bromo-2-naphthalenyl)sulfonyl]-1-piperazinyl]-[4-(2-isocyano-4-pyridinyl)phenyl]methanone IUPAC Name: [4-(6-bromonaphthalen-2-yl)sulfonylpiperazin-1-yl]-[4-(2-isocyanopyridin-4-yl)phenyl]methanone Traditional Name: [4-[(6-bromo-2-naphthyl)sulfonyl]piperazino]-[4-(2-isocyano-4-pyridyl)phenyl]methanone Formula: C27H21BrN4O3S MolecularWeight: 561.44964

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=NC=CC(=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Br

Isomeric SMILES

[C-]#[N+]C1=NC=CC(=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Br

InChI

InChI=1S/C27H21BrN4O3S/c1-29-26-18-23(10-11-30-26)19-2-4-20(5-3-19)27(33)31-12-14-32(15-13-31)36(34,35)25-9-7-21-16-24(28)8-6-22(21)17-25/h2-11,16-18H,12-15H2