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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])N3CCCC3C(=O)NCC(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])N3CCCC3C(=O)NCC(=O)N

InChI

InChI=1S/C19H23N7O5/c1-31-13-6-4-12(5-7-13)9-21-17-16(26(29)30)18(24-11-23-17)25-8-2-3-14(25)19(28)22-10-15(20)27/h4-7,11,14H,2-3,8-10H2,1H3,(H2,20,27)(H,22,28)(H,21,23,24)