N-[4-[2-(3-cyclopropyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)quinolin-4-yl]sulfanylphenyl]ethanamide

Systemtic Name: N-[4-[2-(3-cyclopropyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)quinolin-4-yl]sulfanylphenyl]ethanamide Openeye Name: N-[4-[[2-(3-cyclopropyl-5-oxo-1,2-dihydropyrazol-4-yl)-4-quinolyl]sulfanyl]phenyl]acetamide CAS Name: N-[4-[[2-(3-cyclopropyl-5-oxo-1,2-dihydropyrazol-4-yl)-4-quinolinyl]thio]phenyl]acetamide IUPAC Name: N-[4-[2-(3-cyclopropyl-5-oxo-1,2-dihydropyrazol-4-yl)quinolin-4-yl]sulfanylphenyl]acetamide Traditional Name: N-[4-[[2-(3-cyclopropyl-5-keto-3-pyrazolin-4-yl)-4-quinolyl]thio]phenyl]acetamide Formula: C23H20N4O2S MolecularWeight: 416.4955

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SC2=CC(=NC3=CC=CC=C32)C4=C(NNC4=O)C5CC5

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SC2=CC(=NC3=CC=CC=C32)C4=C(NNC4=O)C5CC5

InChI

InChI=1S/C23H20N4O2S/c1-13(28)24-15-8-10-16(11-9-15)30-20-12-19(25-18-5-3-2-4-17(18)20)21-22(14-6-7-14)26-27-23(21)29/h2-5,8-12,14H,6-7H2,1H3,(H,24,28)(H2,26,27,29)