1-(3-chloranyl-4-methyl-phenyl)-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[(4-keto-3H-phthalazine-1-carbonyl)amino]thiourea Formula: C17H14ClN5O2S MolecularWeight: 387.84336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClN5O2S/c1-9-6-7-10(8-13(9)18)19-17(26)23-22-16(25)14-11-4-2-3-5-12(11)15(24)21-20-14/h2-8H,1H3,(H,21,24)(H,22,25)(H2,19,23,26)