N-cyclopropyl-2-[3-[(5-methyl-1,2-oxazol-3-yl)amino]-3-oxidanylidene-propyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[3-[(5-methyl-1,2-oxazol-3-yl)amino]-3-oxidanylidene-propyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[3-[(5-methylisoxazol-3-yl)amino]-3-oxo-propyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[3-[(5-methyl-3-isoxazolyl)amino]-3-oxopropyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[3-[(5-methyl-1,2-oxazol-3-yl)amino]-3-oxopropyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[3-keto-3-[(5-methylisoxazol-3-yl)amino]propyl]thio]cinchoninamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CCSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CCSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

InChI

InChI=1S/C20H20N4O3S/c1-12-10-17(24-27-12)23-18(25)8-9-28-19-11-15(20(26)21-13-6-7-13)14-4-2-3-5-16(14)22-19/h2-5,10-11,13H,6-9H2,1H3,(H,21,26)(H,23,24,25)