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

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-butyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-butyl-2-hydroxy-4-oxo-quinoline-3-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-butyl-2-hydroxy-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-butyl-2-hydroxy-4-oxoquinoline-3-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-butyl-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H23N3O3S/c1-2-3-16-30-21-10-6-4-8-19(21)24(31)23(27(30)33)25(32)28-18-14-12-17(13-15-18)26-29-20-9-5-7-11-22(20)34-26/h4-15,33H,2-3,16H2,1H3,(H,28,32)