1-(2-ethyl-6-methyl-phenyl)-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(4-keto-3H-phthalazine-1-carbonyl)amino]thiourea Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=NNC(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=NNC(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C19H19N5O2S/c1-3-12-8-6-7-11(2)15(12)20-19(27)24-23-18(26)16-13-9-4-5-10-14(13)17(25)22-21-16/h4-10H,3H2,1-2H3,(H,22,25)(H,23,26)(H2,20,24,27)