N-(2-azanyl-2-oxidanylidene-ethyl)-1-[5-nitro-6-(2-phenoxyethylamino)pyrimidin-4-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-1-[5-nitro-6-(2-phenoxyethylamino)pyrimidin-4-yl]pyrrolidine-2-carboxamide Openeye Name: N-(2-amino-2-oxo-ethyl)-1-[5-nitro-6-(2-phenoxyethylamino)pyrimidin-4-yl]pyrrolidine-2-carboxamide CAS Name: N-(2-amino-2-oxoethyl)-1-[5-nitro-6-(2-phenoxyethylamino)-4-pyrimidinyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-amino-2-oxoethyl)-1-[5-nitro-6-(2-phenoxyethylamino)pyrimidin-4-yl]pyrrolidine-2-carboxamide Traditional Name: N-(2-amino-2-keto-ethyl)-1-[5-nitro-6-(2-phenoxyethylamino)pyrimidin-4-yl]pyrrolidine-2-carboxamide Formula: C19H23N7O5 MolecularWeight: 429.42982

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C(=NC=N2)NCCOC3=CC=CC=C3)[N+](=O)[O-])C(=O)NCC(=O)N

Isomeric SMILES

C1CC(N(C1)C2=C(C(=NC=N2)NCCOC3=CC=CC=C3)[N+](=O)[O-])C(=O)NCC(=O)N

InChI

InChI=1S/C19H23N7O5/c20-15(27)11-22-19(28)14-7-4-9-25(14)18-16(26(29)30)17(23-12-24-18)21-8-10-31-13-5-2-1-3-6-13/h1-3,5-6,12,14H,4,7-11H2,(H2,20,27)(H,22,28)(H,21,23,24)