N-(2-azanyl-2-oxidanylidene-ethyl)-1-[6-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-1-[6-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxamide Openeye Name: N-(2-amino-2-oxo-ethyl)-1-[6-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxamide CAS Name: N-(2-amino-2-oxoethyl)-1-[6-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-5-nitro-4-pyrimidinyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-amino-2-oxoethyl)-1-[6-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-5-nitropyrimidin-4-yl]pyrrolidine-2-carboxamide Traditional Name: N-(2-amino-2-keto-ethyl)-1-[6-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxamide Formula: C19H19N7O5S MolecularWeight: 457.46306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)OC3=NC=NC(=C3[N+](=O)[O-])N4CCCC4C(=O)NCC(=O)N

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)OC3=NC=NC(=C3[N+](=O)[O-])N4CCCC4C(=O)NCC(=O)N

InChI

InChI=1S/C19H19N7O5S/c1-10-24-12-7-11(4-5-14(12)32-10)31-19-16(26(29)30)17(22-9-23-19)25-6-2-3-13(25)18(28)21-8-15(20)27/h4-5,7,9,13H,2-3,6,8H2,1H3,(H2,20,27)(H,21,28)