1-(4-chlorophenyl)-3-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea CAS Name: 1-(4-chlorophenyl)-3-[[1-oxo-2-(1-oxo-2-phthalazinyl)ethyl]amino]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[[2-(1-ketophthalazin-2-yl)acetyl]amino]thiourea Formula: C17H14ClN5O2S MolecularWeight: 387.84336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NNC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NNC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN5O2S/c18-12-5-7-13(8-6-12)20-17(26)22-21-15(24)10-23-16(25)14-4-2-1-3-11(14)9-19-23/h1-9H,10H2,(H,21,24)(H2,20,22,26)