3-azanyl-2-(7-quinolin-2-ylsulfanylheptyl)benzamide

Systemtic Name: 3-azanyl-2-(7-quinolin-2-ylsulfanylheptyl)benzamide Openeye Name: 3-amino-2-[7-(2-quinolylsulfanyl)heptyl]benzamide CAS Name: 3-amino-2-[7-(2-quinolinylthio)heptyl]benzamide IUPAC Name: 3-amino-2-(7-quinolin-2-ylsulfanylheptyl)benzamide Traditional Name: 3-amino-2-[7-(2-quinolylthio)heptyl]benzamide Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCCCCCCCC3=C(C=CC=C3N)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCCCCCCCC3=C(C=CC=C3N)C(=O)N

InChI

InChI=1S/C23H27N3OS/c24-20-12-8-11-19(23(25)27)18(20)10-4-2-1-3-7-16-28-22-15-14-17-9-5-6-13-21(17)26-22/h5-6,8-9,11-15H,1-4,7,10,16,24H2,(H2,25,27)