(4R)-2-(4-ethylpiperazin-1-ium-1-ylidene)-6-oxidanylidene-N-(4-propan-2-ylphenyl)-1,3-diazinane-4-carboxamide

Systemtic Name: (4R)-2-(4-ethylpiperazin-1-ium-1-ylidene)-6-oxidanylidene-N-(4-propan-2-ylphenyl)-1,3-diazinane-4-carboxamide Openeye Name: (4R)-2-(4-ethylpiperazin-1-ium-1-ylidene)-N-(4-isopropylphenyl)-6-oxo-hexahydropyrimidine-4-carboxamide CAS Name: (4R)-2-(4-ethyl-1-piperazin-1-iumylidene)-6-oxo-N-(4-propan-2-ylphenyl)-1,3-diazinane-4-carboxamide IUPAC Name: (4R)-2-(4-ethylpiperazin-1-ium-1-ylidene)-6-oxo-N-(4-propan-2-ylphenyl)-1,3-diazinane-4-carboxamide Traditional Name: (4R)-2-(4-ethylpiperazin-1-ium-1-ylidene)-6-keto-N-p-cumenyl-hexahydropyrimidine-4-carboxamide Formula: C20H30N5O2+ MolecularWeight: 372.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[N+](=C2NC(CC(=O)N2)C(=O)NC3=CC=C(C=C3)C(C)C)CC1

Isomeric SMILES

CCN1CC[N+](=C2N[C@H](CC(=O)N2)C(=O)NC3=CC=C(C=C3)C(C)C)CC1

InChI

InChI=1S/C20H29N5O2/c1-4-24-9-11-25(12-10-24)20-22-17(13-18(26)23-20)19(27)21-16-7-5-15(6-8-16)14(2)3/h5-8,14,17H,4,9-13H2,1-3H3,(H2,21,22,23,26,27)/p+1/t17-/m1/s1