N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]-2-(2-thienyl)cinchoninamide Formula: C23H17N3O3S MolecularWeight: 415.46438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C23H17N3O3S/c1-13-22(27)26-18-11-14(8-9-20(18)29-13)24-23(28)16-12-19(21-7-4-10-30-21)25-17-6-3-2-5-15(16)17/h2-13H,1H3,(H,24,28)(H,26,27)/t13-/m0/s1