1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-(2-chlorophenyl)thiourea

Systemtic Name: 1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-(2-chlorophenyl)thiourea Openeye Name: 1-(2-chlorophenyl)-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea CAS Name: 1-(2-chlorophenyl)-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea IUPAC Name: 1-(2-chlorophenyl)-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea Traditional Name: 1-(2-chlorophenyl)-3-(1,4-diketo-2,3-dihydrophthalazin-5-yl)thiourea Formula: C15H11ClN4O2S MolecularWeight: 346.79144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=S)NC2=CC=CC3=C2C(=O)NNC3=O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=S)NC2=CC=CC3=C2C(=O)NNC3=O)Cl

InChI

InChI=1S/C15H11ClN4O2S/c16-9-5-1-2-6-10(9)17-15(23)18-11-7-3-4-8-12(11)14(22)20-19-13(8)21/h1-7H,(H,19,21)(H,20,22)(H2,17,18,23)