N-[4-[5-nitro-6-[(phenylmethyl)amino]pyrimidin-4-yl]oxyphenyl]ethanamide

Systemtic Name: N-[4-[5-nitro-6-[(phenylmethyl)amino]pyrimidin-4-yl]oxyphenyl]ethanamide Openeye Name: N-[4-[6-(benzylamino)-5-nitro-pyrimidin-4-yl]oxyphenyl]acetamide CAS Name: N-[4-[[5-nitro-6-[(phenylmethyl)amino]-4-pyrimidinyl]oxy]phenyl]acetamide IUPAC Name: N-[4-[6-(benzylamino)-5-nitropyrimidin-4-yl]oxyphenyl]acetamide Traditional Name: N-[4-[6-(benzylamino)-5-nitro-pyrimidin-4-yl]oxyphenyl]acetamide Formula: C19H17N5O4 MolecularWeight: 379.36938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3

InChI

InChI=1S/C19H17N5O4/c1-13(25)23-15-7-9-16(10-8-15)28-19-17(24(26)27)18(21-12-22-19)20-11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,23,25)(H,20,21,22)