N-(1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)quinoline-3-carboxamide

Systemtic Name: N-(1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)quinoline-3-carboxamide Openeye Name: N-(1-carbamoyl-3-methylsulfanyl-propyl)quinoline-3-carboxamide CAS Name: N-[1-amino-4-(methylthio)-1-oxobutan-2-yl]-3-quinolinecarboxamide IUPAC Name: N-(1-amino-4-methylsulfanyl-1-oxobutan-2-yl)quinoline-3-carboxamide Traditional Name: N-[1-carbamoyl-3-(methylthio)propyl]quinoline-3-carboxamide Formula: C15H17N3O2S MolecularWeight: 303.37938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N)NC(=O)C1=CC2=CC=CC=C2N=C1

Isomeric SMILES

CSCCC(C(=O)N)NC(=O)C1=CC2=CC=CC=C2N=C1

InChI

InChI=1S/C15H17N3O2S/c1-21-7-6-13(14(16)19)18-15(20)11-8-10-4-2-3-5-12(10)17-9-11/h2-5,8-9,13H,6-7H2,1H3,(H2,16,19)(H,18,20)