(2S)-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-(3-methylphenoxy)propanamide

Systemtic Name: (2S)-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-(3-methylphenoxy)propanamide Openeye Name: (2S)-N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-2-(3-methylphenoxy)propanamide CAS Name: (2S)-N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-2-(3-methylphenoxy)propanamide IUPAC Name: (2S)-N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-2-(3-methylphenoxy)propanamide Traditional Name: (2S)-N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-2-(3-methylphenoxy)propionamide Formula: C22H32N4O4 MolecularWeight: 416.51388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C(C)OC2=CC=CC(=C2)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)[C@H](C)OC2=CC=CC(=C2)C)N

InChI

InChI=1S/C22H32N4O4/c1-5-7-12-25(21(28)16(4)30-17-11-9-10-15(3)14-17)18-19(23)26(13-8-6-2)22(29)24-20(18)27/h9-11,14,16H,5-8,12-13,23H2,1-4H3,(H,24,27,29)/t16-/m0/s1