5-methanethioyl-1-methyl-2-oxidanyl-4-oxidanylidene-N-phenyl-N-propyl-quinoline-3-carboxamide

Systemtic Name: 5-methanethioyl-1-methyl-2-oxidanyl-4-oxidanylidene-N-phenyl-N-propyl-quinoline-3-carboxamide Openeye Name: 2-hydroxy-5-methanethioyl-1-methyl-4-oxo-N-phenyl-N-propyl-quinoline-3-carboxamide CAS Name: 2-hydroxy-5-methanethioyl-1-methyl-4-oxo-N-phenyl-N-propyl-3-quinolinecarboxamide IUPAC Name: 2-hydroxy-5-methanethioyl-1-methyl-4-oxo-N-phenyl-N-propylquinoline-3-carboxamide Traditional Name: 2-hydroxy-4-keto-1-methyl-N-phenyl-N-propyl-5-thioformyl-quinoline-3-carboxamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=CC=C1)C(=O)C2=C(N(C3=CC=CC(=C3C2=O)C=S)C)O

Isomeric SMILES

CCCN(C1=CC=CC=C1)C(=O)C2=C(N(C3=CC=CC(=C3C2=O)C=S)C)O

InChI

InChI=1S/C21H20N2O3S/c1-3-12-23(15-9-5-4-6-10-15)21(26)18-19(24)17-14(13-27)8-7-11-16(17)22(2)20(18)25/h4-11,13,25H,3,12H2,1-2H3