1-(3,4-dimethylphenyl)-3-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[(4-oxo-3-phenyl-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[oxo-(4-oxo-3-phenyl-1-phthalazinyl)methyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[(4-oxo-3-phenylphthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[(4-keto-3-phenyl-phthalazine-1-carbonyl)amino]thiourea Formula: C24H21N5O2S MolecularWeight: 443.52084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C

InChI

InChI=1S/C24H21N5O2S/c1-15-12-13-17(14-16(15)2)25-24(32)27-26-22(30)21-19-10-6-7-11-20(19)23(31)29(28-21)18-8-4-3-5-9-18/h3-14H,1-2H3,(H,26,30)(H2,25,27,32)