N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide Openeye Name: N-[(4-iodo-2-methyl-phenyl)carbamothioyl]-2-(3-isopropoxyphenyl)quinoline-4-carboxamide CAS Name: N-[(4-iodo-2-methylanilino)-sulfanylidenemethyl]-2-(3-propan-2-yloxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(4-iodo-2-methylphenyl)carbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide Traditional Name: N-[(4-iodo-2-methyl-phenyl)thiocarbamoyl]-2-(3-isopropoxyphenyl)cinchoninamide Formula: C27H24IN3O2S MolecularWeight: 581.46783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)OC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)OC(C)C

InChI

InChI=1S/C27H24IN3O2S/c1-16(2)33-20-8-6-7-18(14-20)25-15-22(21-9-4-5-10-24(21)29-25)26(32)31-27(34)30-23-12-11-19(28)13-17(23)3/h4-16H,1-3H3,(H2,30,31,32,34)