N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(3-methoxypropyl)quinoline-2-carboxamide

Systemtic Name: N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(3-methoxypropyl)quinoline-2-carboxamide Openeye Name: N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-(3-methoxypropyl)quinoline-2-carboxamide CAS Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-(3-methoxypropyl)-2-quinolinecarboxamide IUPAC Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-(3-methoxypropyl)quinoline-2-carboxamide Traditional Name: N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-(3-methoxypropyl)quinaldamide Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5O4/c1-14(2)13-27-19(23)18(20(28)25-22(27)30)26(11-6-12-31-3)21(29)17-10-9-15-7-4-5-8-16(15)24-17/h4-5,7-10,14H,6,11-13,23H2,1-3H3,(H,25,28,30)