[(2S)-1-[(2Z)-2-[(6-methoxyquinolin-2-yl)methylidene]hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[(2Z)-2-[(6-methoxyquinolin-2-yl)methylidene]hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[[(Z)-(6-methoxy-2-quinolyl)methyleneamino]carbamoyl]-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-1-[(2Z)-2-[(6-methoxy-2-quinolinyl)methylidene]hydrazinyl]-4-(methylthio)-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-[(2Z)-2-[(6-methoxyquinolin-2-yl)methylidene]hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[[(Z)-(6-methoxy-2-quinolyl)methyleneamino]carbamoyl]-3-(methylthio)propyl]ammonium Formula: C16H21N4O2S+ MolecularWeight: 333.42854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2)C=NNC(=O)C(CCSC)[NH3+]

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2)/C=N\NC(=O)[C@H](CCSC)[NH3+]

InChI

InChI=1S/C16H20N4O2S/c1-22-13-5-6-15-11(9-13)3-4-12(19-15)10-18-20-16(21)14(17)7-8-23-2/h3-6,9-10,14H,7-8,17H2,1-2H3,(H,20,21)/p+1/b18-10-/t14-/m0/s1