(4S)-N-(4-ethanoylphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-4-carboxamide

Systemtic Name: (4S)-N-(4-ethanoylphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-4-carboxamide Openeye Name: (4S)-N-(4-acetylphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)-6-oxo-4,5-dihydro-1H-pyrimidine-4-carboxamide CAS Name: (4S)-N-(4-acetylphenyl)-2-(4-ethyl-1-piperazin-4-iumyl)-6-oxo-4,5-dihydro-1H-pyrimidine-4-carboxamide IUPAC Name: (4S)-N-(4-acetylphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)-6-oxo-4,5-dihydro-1H-pyrimidine-4-carboxamide Traditional Name: (4S)-N-(4-acetylphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)-6-keto-4,5-dihydro-1H-pyrimidine-4-carboxamide Formula: C19H26N5O3+ MolecularWeight: 372.44144

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(CC(=O)N2)C(=O)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=N[C@@H](CC(=O)N2)C(=O)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C19H25N5O3/c1-3-23-8-10-24(11-9-23)19-21-16(12-17(26)22-19)18(27)20-15-6-4-14(5-7-15)13(2)25/h4-7,16H,3,8-12H2,1-2H3,(H,20,27)(H,21,22,26)/p+1/t16-/m0/s1