N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-octyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-octyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 2-hydroxy-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-octyl-4-oxo-quinoline-3-carboxamide CAS Name: 2-hydroxy-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-octyl-4-oxo-3-quinolinecarboxamide IUPAC Name: 2-hydroxy-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-octyl-4-oxoquinoline-3-carboxamide Traditional Name: 2-hydroxy-4-keto-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-octyl-quinoline-3-carboxamide Formula: C32H33N3O3S MolecularWeight: 539.68772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)C4=NC5=C(S4)C=C(C=C5)C

Isomeric SMILES

CCCCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)C4=NC5=C(S4)C=C(C=C5)C

InChI

InChI=1S/C32H33N3O3S/c1-3-4-5-6-7-10-19-35-26-12-9-8-11-24(26)29(36)28(32(35)38)30(37)33-23-16-14-22(15-17-23)31-34-25-18-13-21(2)20-27(25)39-31/h8-9,11-18,20,38H,3-7,10,19H2,1-2H3,(H,33,37)