sodium 10-(2,3-dimethylpentanoylamino)-4-oxidanylidene-pyrimido[1,2-c]quinazoline-3-carboxylate

Systemtic Name: sodium 10-(2,3-dimethylpentanoylamino)-4-oxidanylidene-pyrimido[1,2-c]quinazoline-3-carboxylate Openeye Name: sodium 10-(2,3-dimethylpentanoylamino)-4-oxo-pyrimido[1,2-c]quinazoline-3-carboxylate CAS Name: sodium 10-[(2,3-dimethyl-1-oxopentyl)amino]-4-oxo-3-pyrimido[1,2-c]quinazolinecarboxylate IUPAC Name: sodium 10-(2,3-dimethylpentanoylamino)-4-oxopyrimido[1,2-c]quinazoline-3-carboxylate Traditional Name: sodium 10-(2,3-dimethylpentanoylamino)-4-keto-pyrimido[1,2-c]quinazoline-3-carboxylate Formula: C19H19N4NaO4 MolecularWeight: 390.36833

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)C(=O)NC1=CC2=C(C=C1)N=CN3C2=NC=C(C3=O)C(=O)[O-].[Na+]

Isomeric SMILES

CCC(C)C(C)C(=O)NC1=CC2=C(C=C1)N=CN3C2=NC=C(C3=O)C(=O)[O-].[Na+]

InChI

InChI=1S/C19H20N4O4.Na/c1-4-10(2)11(3)17(24)22-12-5-6-15-13(7-12)16-20-8-14(19(26)27)18(25)23(16)9-21-15;/h5-11H,4H2,1-3H3,(H,22,24)(H,26,27);/q;+1/p-1