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

Systemtic Name: N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(2-methoxyethyl)-2-phenyl-quinoline-4-carboxamide Openeye Name: N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-(2-methoxyethyl)-2-phenyl-quinoline-4-carboxamide CAS Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-(2-methoxyethyl)-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-(2-methoxyethyl)-2-phenylquinoline-4-carboxamide Traditional Name: N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-(2-methoxyethyl)-2-phenyl-cinchoninamide Formula: C27H29N5O4 MolecularWeight: 487.55026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N

InChI

InChI=1S/C27H29N5O4/c1-17(2)16-32-24(28)23(25(33)30-27(32)35)31(13-14-36-3)26(34)20-15-22(18-9-5-4-6-10-18)29-21-12-8-7-11-19(20)21/h4-12,15,17H,13-14,16,28H2,1-3H3,(H,30,33,35)