[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium Openeye Name: [2-(ethoxycarbonylamino)-2-oxo-ethyl]-ethyl-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]ammonium CAS Name: [2-(ethoxycarbonylamino)-2-oxoethyl]-ethyl-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: [2-(ethoxycarbonylamino)-2-oxoethyl]-ethyl-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium Traditional Name: [2-(carbethoxyamino)-2-keto-ethyl]-ethyl-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]ammonium Formula: C17H27N6O4+ MolecularWeight: 379.43408

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC(=O)OCC)CC(=O)N1CCN(CC1)C2=NC=CC=N2

Isomeric SMILES

CC[NH+](CC(=O)NC(=O)OCC)CC(=O)N1CCN(CC1)C2=NC=CC=N2

InChI

InChI=1S/C17H26N6O4/c1-3-21(12-14(24)20-17(26)27-4-2)13-15(25)22-8-10-23(11-9-22)16-18-6-5-7-19-16/h5-7H,3-4,8-13H2,1-2H3,(H,20,24,26)/p+1