N-[6-oxidanylidene-6-(pyridin-3-ylamino)hexyl]-2-sulfanyl-benzamide

Systemtic Name: N-[6-oxidanylidene-6-(pyridin-3-ylamino)hexyl]-2-sulfanyl-benzamide Openeye Name: N-[6-oxo-6-(3-pyridylamino)hexyl]-2-sulfanyl-benzamide CAS Name: 2-mercapto-N-[6-oxo-6-(3-pyridinylamino)hexyl]benzamide IUPAC Name: N-[6-oxo-6-(pyridin-3-ylamino)hexyl]-2-sulfanylbenzamide Traditional Name: N-[6-keto-6-(3-pyridylamino)hexyl]-2-mercapto-benzamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCCCCC(=O)NC2=CN=CC=C2)S

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCCCCC(=O)NC2=CN=CC=C2)S

InChI

InChI=1S/C18H21N3O2S/c22-17(21-14-7-6-11-19-13-14)10-2-1-5-12-20-18(23)15-8-3-4-9-16(15)24/h3-4,6-9,11,13,24H,1-2,5,10,12H2,(H,20,23)(H,21,22)