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

Systemtic Name: 1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-cyclohexyl-thiourea Openeye Name: 1-cyclohexyl-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea CAS Name: 1-cyclohexyl-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea IUPAC Name: 1-cyclohexyl-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea Traditional Name: 1-cyclohexyl-3-(1,4-diketo-2,3-dihydrophthalazin-5-yl)thiourea Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=CC=CC3=C2C(=O)NNC3=O

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=CC=CC3=C2C(=O)NNC3=O

InChI

InChI=1S/C15H18N4O2S/c20-13-10-7-4-8-11(12(10)14(21)19-18-13)17-15(22)16-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,18,20)(H,19,21)(H2,16,17,22)