N-(4-cyclopentylsulfanylphenyl)-6-oxidanylidene-1H-pyridazine-3-carboxamide

Systemtic Name: N-(4-cyclopentylsulfanylphenyl)-6-oxidanylidene-1H-pyridazine-3-carboxamide Openeye Name: N-(4-cyclopentylsulfanylphenyl)-6-oxo-1H-pyridazine-3-carboxamide CAS Name: N-[4-(cyclopentylthio)phenyl]-6-oxo-1H-pyridazine-3-carboxamide IUPAC Name: N-(4-cyclopentylsulfanylphenyl)-6-oxo-1H-pyridazine-3-carboxamide Traditional Name: N-[4-(cyclopentylthio)phenyl]-6-keto-1H-pyridazine-3-carboxamide Formula: C16H17N3O2S MolecularWeight: 315.39008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3=NNC(=O)C=C3

Isomeric SMILES

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3=NNC(=O)C=C3

InChI

InChI=1S/C16H17N3O2S/c20-15-10-9-14(18-19-15)16(21)17-11-5-7-13(8-6-11)22-12-3-1-2-4-12/h5-10,12H,1-4H2,(H,17,21)(H,19,20)