N-quinolin-3-yl-5-(2-sulfanylethanoylamino)pentanamide

Systemtic Name: N-quinolin-3-yl-5-(2-sulfanylethanoylamino)pentanamide Openeye Name: N-(3-quinolyl)-5-[(2-sulfanylacetyl)amino]pentanamide CAS Name: 5-[(2-mercapto-1-oxoethyl)amino]-N-(3-quinolinyl)pentanamide IUPAC Name: N-quinolin-3-yl-5-[(2-sulfanylacetyl)amino]pentanamide Traditional Name: 5-[(2-mercaptoacetyl)amino]-N-(3-quinolyl)valeramide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)CCCCNC(=O)CS

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)CCCCNC(=O)CS

InChI

InChI=1S/C16H19N3O2S/c20-15(7-3-4-8-17-16(21)11-22)19-13-9-12-5-1-2-6-14(12)18-10-13/h1-2,5-6,9-10,22H,3-4,7-8,11H2,(H,17,21)(H,19,20)