N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-quinolin-2-ylsulfanyl-propanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-quinolin-2-ylsulfanyl-propanamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(2-quinolylsulfanyl)propanamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(2-quinolinylthio)propanamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-quinolin-2-ylsulfanylpropanamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(2-quinolylthio)propionamide Formula: C25H19N3OS2 MolecularWeight: 441.56786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCCC(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCCC(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H19N3OS2/c29-23(15-16-30-24-14-11-17-5-1-2-6-20(17)27-24)26-19-12-9-18(10-13-19)25-28-21-7-3-4-8-22(21)31-25/h1-14H,15-16H2,(H,26,29)