1-(3-ethanoylphenyl)-3-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]thiourea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]thiourea Openeye Name: 1-(3-acetylphenyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea CAS Name: 1-(3-acetylphenyl)-3-[[1-oxo-2-(1-oxo-2-phthalazinyl)ethyl]amino]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea Traditional Name: 1-(3-acetylphenyl)-3-[[2-(1-ketophthalazin-2-yl)acetyl]amino]thiourea Formula: C19H17N5O3S MolecularWeight: 395.43498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)NNC(=O)CN2C(=O)C3=CC=CC=C3C=N2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)NNC(=O)CN2C(=O)C3=CC=CC=C3C=N2

InChI

InChI=1S/C19H17N5O3S/c1-12(25)13-6-4-7-15(9-13)21-19(28)23-22-17(26)11-24-18(27)16-8-3-2-5-14(16)10-20-24/h2-10H,11H2,1H3,(H,22,26)(H2,21,23,28)