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

Systemtic Name: 1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea Traditional Name: 1-(1,4-diketo-2,3-dihydrophthalazin-5-yl)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiourea Formula: C20H18N6O3S MolecularWeight: 422.46032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=CC=CC4=C3C(=O)NNC4=O

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=CC=CC4=C3C(=O)NNC4=O

InChI

InChI=1S/C20H18N6O3S/c1-11-16(19(29)26(25(11)2)12-7-4-3-5-8-12)22-20(30)21-14-10-6-9-13-15(14)18(28)24-23-17(13)27/h3-10H,1-2H3,(H,23,27)(H,24,28)(H2,21,22,30)