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

Systemtic Name: (2S)-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-ethyl-2-(3-methylphenoxy)propanamide Openeye Name: (2S)-N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-ethyl-2-(3-methylphenoxy)propanamide CAS Name: (2S)-N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-ethyl-2-(3-methylphenoxy)propanamide IUPAC Name: (2S)-N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-ethyl-2-(3-methylphenoxy)propanamide Traditional Name: (2S)-N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-ethyl-2-(3-methylphenoxy)propionamide Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O4/c1-5-7-11-24-17(21)16(18(25)22-20(24)27)23(6-2)19(26)14(4)28-15-10-8-9-13(3)12-15/h8-10,12,14H,5-7,11,21H2,1-4H3,(H,22,25,27)/t14-/m0/s1