1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]-3-(4-fluorobenzyl)thiourea Formula: C19H18FN5O2S MolecularWeight: 399.441923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H18FN5O2S/c1-2-25-18(27)15-6-4-3-5-14(15)16(24-25)17(26)22-23-19(28)21-11-12-7-9-13(20)10-8-12/h3-10H,2,11H2,1H3,(H,22,26)(H2,21,23,28)