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

Systemtic Name: 1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-propan-2-yl-thiourea Openeye Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-isopropyl-thiourea CAS Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-propan-2-ylthiourea IUPAC Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-propan-2-ylthiourea Traditional Name: 1-(1,4-diketo-2,3-dihydrophthalazin-5-yl)-3-isopropyl-thiourea Formula: C12H14N4O2S MolecularWeight: 278.33016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=CC=CC2=C1C(=O)NNC2=O

Isomeric SMILES

CC(C)NC(=S)NC1=CC=CC2=C1C(=O)NNC2=O

InChI

InChI=1S/C12H14N4O2S/c1-6(2)13-12(19)14-8-5-3-4-7-9(8)11(18)16-15-10(7)17/h3-6H,1-2H3,(H,15,17)(H,16,18)(H2,13,14,19)