4-(pentylamino)-2-quinolin-3-ylsulfanyl-butanamide

Systemtic Name: 4-(pentylamino)-2-quinolin-3-ylsulfanyl-butanamide Openeye Name: 4-(pentylamino)-2-(3-quinolylsulfanyl)butanamide CAS Name: 4-(pentylamino)-2-(3-quinolinylthio)butanamide IUPAC Name: 4-(pentylamino)-2-quinolin-3-ylsulfanylbutanamide Traditional Name: 4-(amylamino)-2-(3-quinolylthio)butyramide Formula: C18H25N3OS MolecularWeight: 331.4756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCCC(C(=O)N)SC1=CC2=CC=CC=C2N=C1

Isomeric SMILES

CCCCCNCCC(C(=O)N)SC1=CC2=CC=CC=C2N=C1

InChI

InChI=1S/C18H25N3OS/c1-2-3-6-10-20-11-9-17(18(19)22)23-15-12-14-7-4-5-8-16(14)21-13-15/h4-5,7-8,12-13,17,20H,2-3,6,9-11H2,1H3,(H2,19,22)