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

Systemtic Name: 1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-(4-isopropylphenyl)thiourea CAS Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-(1,4-diketo-2,3-dihydrophthalazin-5-yl)-3-p-cumenyl-thiourea Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O2S/c1-10(2)11-6-8-12(9-7-11)19-18(25)20-14-5-3-4-13-15(14)17(24)22-21-16(13)23/h3-10H,1-2H3,(H,21,23)(H,22,24)(H2,19,20,25)