2-[[(cyclohexylcarbonylamino)-quinazolin-4-yl-amino]methylidene]propanedioate

Systemtic Name: 2-[[(cyclohexylcarbonylamino)-quinazolin-4-yl-amino]methylidene]propanedioate Openeye Name: 2-[[(cyclohexanecarbonylamino)-quinazolin-4-yl-amino]methylene]propanedioate CAS Name: 2-[[[[cyclohexyl(oxo)methyl]amino]-(4-quinazolinyl)amino]methylidene]propanedioate IUPAC Name: 2-[[(cyclohexanecarbonylamino)-quinazolin-4-ylamino]methylidene]propanedioate Traditional Name: 2-[[(cyclohexanecarbonylamino)-quinazolin-4-yl-amino]methylene]malonate Formula: C19H18N4O5-2 MolecularWeight: 382.37002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NN(C=C(C(=O)[O-])C(=O)[O-])C2=NC=NC3=CC=CC=C32

Isomeric SMILES

C1CCC(CC1)C(=O)NN(C=C(C(=O)[O-])C(=O)[O-])C2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C19H20N4O5/c24-17(12-6-2-1-3-7-12)22-23(10-14(18(25)26)19(27)28)16-13-8-4-5-9-15(13)20-11-21-16/h4-5,8-12H,1-3,6-7H2,(H,22,24)(H,25,26)(H,27,28)/p-2