1-[3,5-bis(chloranyl)phenyl]-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-[3,5-bis(chloranyl)phenyl]-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(3,5-dichlorophenyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(3,5-dichlorophenyl)-3-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]thiourea IUPAC Name: 1-(3,5-dichlorophenyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-(3,5-dichlorophenyl)-3-[(4-keto-3H-phthalazine-1-carbonyl)amino]thiourea Formula: C16H11Cl2N5O2S MolecularWeight: 408.26184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=S)NC3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=S)NC3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C16H11Cl2N5O2S/c17-8-5-9(18)7-10(6-8)19-16(26)23-22-15(25)13-11-3-1-2-4-12(11)14(24)21-20-13/h1-7H,(H,21,24)(H,22,25)(H2,19,23,26)