(4-bromanyl-2-piperidin-1-ylcarbothioyl-phenyl) naphthalene-1-carboxylate

Systemtic Name: (4-bromanyl-2-piperidin-1-ylcarbothioyl-phenyl) naphthalene-1-carboxylate Openeye Name: [4-bromo-2-(piperidine-1-carbothioyl)phenyl] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [4-bromo-2-[1-piperidinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [4-bromo-2-(piperidine-1-carbothioyl)phenyl] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [4-bromo-2-(piperidine-1-carbothioyl)phenyl] ester Formula: C23H20BrNO2S MolecularWeight: 454.3794

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)C2=C(C=CC(=C2)Br)OC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)C(=S)C2=C(C=CC(=C2)Br)OC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H20BrNO2S/c24-17-11-12-21(20(15-17)22(28)25-13-4-1-5-14-25)27-23(26)19-10-6-8-16-7-2-3-9-18(16)19/h2-3,6-12,15H,1,4-5,13-14H2