ethyl N-[3-[(5-oxidanylidene-6H-pyrido[2,3-d]pyridazin-8-yl)amino]propylcarbamothioyl]carbamate

Systemtic Name: ethyl N-[3-[(5-oxidanylidene-6H-pyrido[2,3-d]pyridazin-8-yl)amino]propylcarbamothioyl]carbamate Openeye Name: ethyl N-[3-[(5-oxo-6H-pyrido[2,3-d]pyridazin-8-yl)amino]propylcarbamothioyl]carbamate CAS Name: N-[[3-[(5-oxo-6H-pyrido[2,3-d]pyridazin-8-yl)amino]propylamino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-[(5-oxo-6H-pyrido[2,3-d]pyridazin-8-yl)amino]propylcarbamothioyl]carbamate Traditional Name: N-[3-[(5-keto-6H-pyrido[2,3-d]pyridazin-8-yl)amino]propylthiocarbamoyl]carbamic acid ethyl ester Formula: C14H18N6O3S MolecularWeight: 350.39612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NCCCNC1=NNC(=O)C2=C1N=CC=C2

Isomeric SMILES

CCOC(=O)NC(=S)NCCCNC1=NNC(=O)C2=C1N=CC=C2

InChI

InChI=1S/C14H18N6O3S/c1-2-23-14(22)18-13(24)17-8-4-7-16-11-10-9(5-3-6-15-10)12(21)20-19-11/h3,5-6H,2,4,7-8H2,1H3,(H,16,19)(H,20,21)(H2,17,18,22,24)