4-azanyl-5-chloranyl-2-methoxy-N-[3-methoxy-1-[3-(pyrimidin-2-ylamino)propyl]piperidin-4-yl]benzamide

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[3-methoxy-1-[3-(pyrimidin-2-ylamino)propyl]piperidin-4-yl]benzamide Openeye Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-(pyrimidin-2-ylamino)propyl]-4-piperidyl]benzamide CAS Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-(2-pyrimidinylamino)propyl]-4-piperidinyl]benzamide IUPAC Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-(pyrimidin-2-ylamino)propyl]piperidin-4-yl]benzamide Traditional Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-(2-pyrimidylamino)propyl]-4-piperidyl]benzamide Formula: C21H29ClN6O3 MolecularWeight: 448.94636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCNC3=NC=CC=N3

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCNC3=NC=CC=N3

InChI

InChI=1S/C21H29ClN6O3/c1-30-18-12-16(23)15(22)11-14(18)20(29)27-17-5-10-28(13-19(17)31-2)9-4-8-26-21-24-6-3-7-25-21/h3,6-7,11-12,17,19H,4-5,8-10,13,23H2,1-2H3,(H,27,29)(H,24,25,26)