[4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-propanoyl-carbamothioic S-acid

Systemtic Name: [4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-propanoyl-carbamothioic S-acid Openeye Name: [4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-propanoyl-carbamothioic S-acid CAS Name: [4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-(1-oxopropyl)carbamothioic S-acid IUPAC Name: [4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-propanoylcarbamothioic S-acid Traditional Name: [4-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-propionyl-thiocarbamic S-acid Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=C(C=C1)C2=NNC(=O)CC2)C(=O)S

Isomeric SMILES

CCC(=O)N(C1=CC=C(C=C1)C2=NNC(=O)CC2)C(=O)S

InChI

InChI=1S/C14H15N3O3S/c1-2-13(19)17(14(20)21)10-5-3-9(4-6-10)11-7-8-12(18)16-15-11/h3-6H,2,7-8H2,1H3,(H,16,18)(H,20,21)