N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(2-methylpropyl)-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(2-methylpropyl)-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-isobutyl-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(2-methylpropyl)-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-(2-methylpropyl)-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-2-(4-pyridyl)cinchoninamide Formula: C27H30N6O3 MolecularWeight: 486.5655

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)N

InChI

InChI=1S/C27H30N6O3/c1-4-5-14-32-24(28)23(25(34)31-27(32)36)33(16-17(2)3)26(35)20-15-22(18-10-12-29-13-11-18)30-21-9-7-6-8-19(20)21/h6-13,15,17H,4-5,14,16,28H2,1-3H3,(H,31,34,36)