1-[1-[2-(chloromethyl)-4-oxidanylidene-quinazolin-3-yl]prop-1-en-2-ylamino]urea

Systemtic Name: 1-[1-[2-(chloromethyl)-4-oxidanylidene-quinazolin-3-yl]prop-1-en-2-ylamino]urea Openeye Name: [[2-[2-(chloromethyl)-4-oxo-quinazolin-3-yl]-1-methyl-vinyl]amino]urea CAS Name: [1-[2-(chloromethyl)-4-oxo-3-quinazolinyl]prop-1-en-2-ylamino]urea IUPAC Name: [1-[2-(chloromethyl)-4-oxoquinazolin-3-yl]prop-1-en-2-ylamino]urea Traditional Name: [[2-[2-(chloromethyl)-4-keto-quinazolin-3-yl]-1-methyl-vinyl]amino]urea Formula: C13H14ClN5O2 MolecularWeight: 307.73556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

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/h2-5,7,17H,6H2,1H3,(H3,15,18,21)