2-[[[6-[bis(3,3-dimethylbutanoyl)amino]quinazolin-4-yl]amino]methylidene]propanedioate

Systemtic Name: 2-[[[6-[bis(3,3-dimethylbutanoyl)amino]quinazolin-4-yl]amino]methylidene]propanedioate Openeye Name: 2-[[[6-[bis(3,3-dimethylbutanoyl)amino]quinazolin-4-yl]amino]methylene]propanedioate CAS Name: 2-[[[6-[bis(3,3-dimethyl-1-oxobutyl)amino]-4-quinazolinyl]amino]methylidene]propanedioate IUPAC Name: 2-[[[6-[bis(3,3-dimethylbutanoyl)amino]quinazolin-4-yl]amino]methylidene]propanedioate Traditional Name: 2-[[[6-[bis(3,3-dimethylbutanoyl)amino]quinazolin-4-yl]amino]methylene]malonate Formula: C24H28N4O6-2 MolecularWeight: 468.50232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(C1=CC2=C(C=C1)N=CN=C2NC=C(C(=O)[O-])C(=O)[O-])C(=O)CC(C)(C)C

Isomeric SMILES

CC(C)(C)CC(=O)N(C1=CC2=C(C=C1)N=CN=C2NC=C(C(=O)[O-])C(=O)[O-])C(=O)CC(C)(C)C

InChI

InChI=1S/C24H30N4O6/c1-23(2,3)10-18(29)28(19(30)11-24(4,5)6)14-7-8-17-15(9-14)20(27-13-26-17)25-12-16(21(31)32)22(33)34/h7-9,12-13H,10-11H2,1-6H3,(H,31,32)(H,33,34)(H,25,26,27)/p-2