(4R)-N-(3-chlorophenyl)-2-(4-methylpiperazin-1-ium-1-ylidene)-6-oxidanylidene-1,3-diazinane-4-carboxamide

Systemtic Name: (4R)-N-(3-chlorophenyl)-2-(4-methylpiperazin-1-ium-1-ylidene)-6-oxidanylidene-1,3-diazinane-4-carboxamide Openeye Name: (4R)-N-(3-chlorophenyl)-2-(4-methylpiperazin-1-ium-1-ylidene)-6-oxo-hexahydropyrimidine-4-carboxamide CAS Name: (4R)-N-(3-chlorophenyl)-2-(4-methyl-1-piperazin-1-iumylidene)-6-oxo-1,3-diazinane-4-carboxamide IUPAC Name: (4R)-N-(3-chlorophenyl)-2-(4-methylpiperazin-1-ium-1-ylidene)-6-oxo-1,3-diazinane-4-carboxamide Traditional Name: (4R)-N-(3-chlorophenyl)-6-keto-2-(4-methylpiperazin-1-ium-1-ylidene)hexahydropyrimidine-4-carboxamide Formula: C16H21ClN5O2+ MolecularWeight: 350.82324

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](=C2NC(CC(=O)N2)C(=O)NC3=CC(=CC=C3)Cl)CC1

Isomeric SMILES

CN1CC[N+](=C2N[C@H](CC(=O)N2)C(=O)NC3=CC(=CC=C3)Cl)CC1

InChI

InChI=1S/C16H20ClN5O2/c1-21-5-7-22(8-6-21)16-19-13(10-14(23)20-16)15(24)18-12-4-2-3-11(17)9-12/h2-4,9,13H,5-8,10H2,1H3,(H2,18,19,20,23,24)/p+1/t13-/m1/s1