N-[3-[2-(ethylamino)-2-oxidanylidene-ethoxy]phenyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-[3-[2-(ethylamino)-2-oxidanylidene-ethoxy]phenyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-[3-[2-(ethylamino)-2-oxo-ethoxy]phenyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-[3-[2-(ethylamino)-2-keto-ethoxy]phenyl]-3-(2-pyrimidylamino)benzamide Formula: C21H21N5O3 MolecularWeight: 391.42314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)COC1=CC=CC(=C1)NC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3

Isomeric SMILES

CCNC(=O)COC1=CC=CC(=C1)NC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3

InChI

InChI=1S/C21H21N5O3/c1-2-22-19(27)14-29-18-9-4-8-17(13-18)25-20(28)15-6-3-7-16(12-15)26-21-23-10-5-11-24-21/h3-13H,2,14H2,1H3,(H,22,27)(H,25,28)(H,23,24,26)