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

Systemtic Name: N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(2-methylpropyl)quinoline-2-carboxamide Openeye Name: N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-isobutyl-quinoline-2-carboxamide CAS Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-(2-methylpropyl)-2-quinolinecarboxamide IUPAC Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-(2-methylpropyl)quinoline-2-carboxamide Traditional Name: N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-quinaldamide Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=NC3=CC=CC=C3C=C2)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=NC3=CC=CC=C3C=C2)N

InChI

InChI=1S/C22H27N5O3/c1-13(2)11-26(18-19(23)27(12-14(3)4)22(30)25-20(18)28)21(29)17-10-9-15-7-5-6-8-16(15)24-17/h5-10,13-14H,11-12,23H2,1-4H3,(H,25,28,30)