1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-(2,6-diethylphenyl)thiourea

Systemtic Name: 1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-(2,6-diethylphenyl)thiourea Openeye Name: 1-(2,6-diethylphenyl)-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea CAS Name: 1-(2,6-diethylphenyl)-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea IUPAC Name: 1-(2,6-diethylphenyl)-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea Traditional Name: 1-(2,6-diethylphenyl)-3-(1,4-diketo-2,3-dihydrophthalazin-5-yl)thiourea Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC=CC3=C2C(=O)NNC3=O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC=CC3=C2C(=O)NNC3=O

InChI

InChI=1S/C19H20N4O2S/c1-3-11-7-5-8-12(4-2)16(11)21-19(26)20-14-10-6-9-13-15(14)18(25)23-22-17(13)24/h5-10H,3-4H2,1-2H3,(H,22,24)(H,23,25)(H2,20,21,26)