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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C(C)OC2=CC=CC=C2

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)[C@H](C)OC2=CC=CC=C2

InChI

InChI=1S/C20H28N4O4/c1-4-6-13-23(19(26)14(3)28-15-10-8-7-9-11-15)16-17(21)24(12-5-2)20(27)22-18(16)25/h7-11,14H,4-6,12-13,21H2,1-3H3,(H,22,25,27)/t14-/m0/s1