2-(4-acetamidophenyl)sulfanyl-N-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-cyclopropyl-quinoline-4-carboxamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-cyclopropyl-quinoline-4-carboxamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-cyclopropyl-4-quinolinecarboxamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-cyclopropylquinoline-4-carboxamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-cyclopropyl-cinchoninamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

InChI

InChI=1S/C21H19N3O2S/c1-13(25)22-14-8-10-16(11-9-14)27-20-12-18(21(26)23-15-6-7-15)17-4-2-3-5-19(17)24-20/h2-5,8-12,15H,6-7H2,1H3,(H,22,25)(H,23,26)