diethyl 2-[[2,4-bis(azanyl)quinazolin-6-yl]carbonylamino]pentanedioate

Systemtic Name: diethyl 2-[[2,4-bis(azanyl)quinazolin-6-yl]carbonylamino]pentanedioate Openeye Name: diethyl 2-[(2,4-diaminoquinazoline-6-carbonyl)amino]pentanedioate CAS Name: 2-[[(2,4-diamino-6-quinazolinyl)-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2,4-diaminoquinazoline-6-carbonyl)amino]pentanedioate Traditional Name: 2-[(2,4-diaminoquinazoline-6-carbonyl)amino]glutaric acid diethyl ester Formula: C18H23N5O5 MolecularWeight: 389.40572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC2=C(C=C1)N=C(N=C2N)N

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC2=C(C=C1)N=C(N=C2N)N

InChI

InChI=1S/C18H23N5O5/c1-3-27-14(24)8-7-13(17(26)28-4-2)21-16(25)10-5-6-12-11(9-10)15(19)23-18(20)22-12/h5-6,9,13H,3-4,7-8H2,1-2H3,(H,21,25)(H4,19,20,22,23)