(5S)-1-(4-ethoxyphenyl)-5-(3-imidazol-1-ylpropyliminomethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: (5S)-1-(4-ethoxyphenyl)-5-(3-imidazol-1-ylpropyliminomethyl)-1,3-diazinane-2,4,6-trione Openeye Name: (5S)-1-(4-ethoxyphenyl)-5-(3-imidazol-1-ylpropyliminomethyl)hexahydropyrimidine-2,4,6-trione CAS Name: (5S)-1-(4-ethoxyphenyl)-5-[3-(1-imidazolyl)propyliminomethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: (5S)-1-(4-ethoxyphenyl)-5-(3-imidazol-1-ylpropyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: (5S)-5-(3-imidazol-1-ylpropyliminomethyl)-1-p-phenetyl-barbituric acid Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)C=NCCCN3C=CN=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)[C@H](C(=O)NC2=O)C=NCCCN3C=CN=C3

InChI

InChI=1S/C19H21N5O4/c1-2-28-15-6-4-14(5-7-15)24-18(26)16(17(25)22-19(24)27)12-20-8-3-10-23-11-9-21-13-23/h4-7,9,11-13,16H,2-3,8,10H2,1H3,(H,22,25,27)/t16-/m0/s1