N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-ethyl-N-(3-methylbutyl)benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-ethyl-N-(3-methylbutyl)benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-4-ethyl-N-isopentyl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-4-ethyl-N-(3-methylbutyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-4-ethyl-N-(3-methylbutyl)benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-4-ethyl-N-isoamyl-benzamide Formula: C22H32N4O3 MolecularWeight: 400.51448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)C2=CC=C(C=C2)CC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)C2=CC=C(C=C2)CC)N

InChI

InChI=1S/C22H32N4O3/c1-5-7-13-26-19(23)18(20(27)24-22(26)29)25(14-12-15(3)4)21(28)17-10-8-16(6-2)9-11-17/h8-11,15H,5-7,12-14,23H2,1-4H3,(H,24,27,29)