ethyl N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propylcarbamothioyl]carbamate

Systemtic Name: ethyl N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propylcarbamothioyl]carbamate Openeye Name: ethyl N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylcarbamothioyl]carbamate CAS Name: N-[[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylamino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylcarbamothioyl]carbamate Traditional Name: N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propylthiocarbamoyl]carbamic acid ethyl ester Formula: C15H19N5O3S MolecularWeight: 349.40806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NCCCNC1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CCOC(=O)NC(=S)NCCCNC1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C15H19N5O3S/c1-2-23-15(22)18-14(24)17-9-5-8-16-12-10-6-3-4-7-11(10)13(21)20-19-12/h3-4,6-7H,2,5,8-9H2,1H3,(H,16,19)(H,20,21)(H2,17,18,22,24)