tert-butyl N-[1-[2-[1-(3-nitrophenyl)ethylamino]pyrimidin-4-yl]benzimidazol-5-yl]carbamate

Systemtic Name: tert-butyl N-[1-[2-[1-(3-nitrophenyl)ethylamino]pyrimidin-4-yl]benzimidazol-5-yl]carbamate Openeye Name: tert-butyl N-[1-[2-[1-(3-nitrophenyl)ethylamino]pyrimidin-4-yl]benzimidazol-5-yl]carbamate CAS Name: N-[1-[2-[1-(3-nitrophenyl)ethylamino]-4-pyrimidinyl]-5-benzimidazolyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[2-[1-(3-nitrophenyl)ethylamino]pyrimidin-4-yl]benzimidazol-5-yl]carbamate Traditional Name: N-[1-[2-[1-(3-nitrophenyl)ethylamino]pyrimidin-4-yl]benzimidazol-5-yl]carbamic acid tert-butyl ester Formula: C24H25N7O4 MolecularWeight: 475.4998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H25N7O4/c1-15(16-6-5-7-18(12-16)31(33)34)27-22-25-11-10-21(29-22)30-14-26-19-13-17(8-9-20(19)30)28-23(32)35-24(2,3)4/h5-15H,1-4H3,(H,28,32)(H,25,27,29)