1-[(E)-1-[2-(chloromethyl)-4-oxidanylidene-quinazolin-3-yl]propan-2-ylideneamino]urea

Systemtic Name: 1-[(E)-1-[2-(chloromethyl)-4-oxidanylidene-quinazolin-3-yl]propan-2-ylideneamino]urea Openeye Name: [(E)-[2-[2-(chloromethyl)-4-oxo-quinazolin-3-yl]-1-methyl-ethylidene]amino]urea CAS Name: [(E)-1-[2-(chloromethyl)-4-oxo-3-quinazolinyl]propan-2-ylideneamino]urea IUPAC Name: [(E)-1-[2-(chloromethyl)-4-oxoquinazolin-3-yl]propan-2-ylideneamino]urea Traditional Name: [(E)-[2-[2-(chloromethyl)-4-keto-quinazolin-3-yl]-1-methyl-ethylidene]amino]urea Formula: C13H14ClN5O2 MolecularWeight: 307.73556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)N)CN1C(=NC2=CC=CC=C2C1=O)CCl

Isomeric SMILES

C/C(=N\NC(=O)N)/CN1C(=NC2=CC=CC=C2C1=O)CCl

InChI

InChI=1S/C13H14ClN5O2/c1-8(17-18-13(15)21)7-19-11(6-14)16-10-5-3-2-4-9(10)12(19)20/h2-5H,6-7H2,1H3,(H3,15,18,21)/b17-8+