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2-(3-bromophenyl)-N-[(4-cyanophenyl)carbamothioyl]quinoline-4-carboxamide

2-(3-bromophenyl)-N-[(4-cyanophenyl)carbamothioyl]quinoline-4-carboxamide

Systemtic Name:2-(3-bromophenyl)-N-[(4-cyanophenyl)carbamothioyl]quinoline-4-carboxamide
Openeye Name:2-(3-bromophenyl)-N-[(4-cyanophenyl)carbamothioyl]quinoline-4-carboxamide
CAS Name:2-(3-bromophenyl)-N-[(4-cyanoanilino)-sulfanylidenemethyl]-4-quinolinecarboxamide
IUPAC Name:2-(3-bromophenyl)-N-[(4-cyanophenyl)carbamothioyl]quinoline-4-carboxamide
Traditional Name:2-(3-bromophenyl)-N-[(4-cyanophenyl)thiocarbamoyl]cinchoninamide
Formula: C24H15BrN4OS
MolecularWeight: 487.3711
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)NC(=S)NC4=CC=C(C=C4)C#N


Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)NC(=S)NC4=CC=C(C=C4)C#N


InChI

InChI=1S/C24H15BrN4OS/c25-17-5-3-4-16(12-17)22-13-20(19-6-1-2-7-21(19)28-22)23(30)29-24(31)27-18-10-8-15(14-26)9-11-18/h1-13H,(H2,27,29,30,31)


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