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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C2=NC3=CC=CC=C3C(=C2)SC4=CC=C(C=C4)NC(=O)C5CC5

Isomeric SMILES

CC1=C(C(=O)NN1)C2=NC3=CC=CC=C3C(=C2)SC4=CC=C(C=C4)NC(=O)C5CC5

InChI

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