5-chloranyl-4-[3-(methylamino)propylamino]-2-(phenylmethoxymethyl)pyridazin-3-one

Systemtic Name: 5-chloranyl-4-[3-(methylamino)propylamino]-2-(phenylmethoxymethyl)pyridazin-3-one Openeye Name: 2-(benzyloxymethyl)-5-chloro-4-[3-(methylamino)propylamino]pyridazin-3-one CAS Name: 5-chloro-4-[3-(methylamino)propylamino]-2-(phenylmethoxymethyl)-3-pyridazinone IUPAC Name: 5-chloro-4-[3-(methylamino)propylamino]-2-(phenylmethoxymethyl)pyridazin-3-one Traditional Name: 2-(benzoxymethyl)-5-chloro-4-[3-(methylamino)propylamino]pyridazin-3-one Formula: C16H21ClN4O2 MolecularWeight: 336.81654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCCCNC1=C(C=NN(C1=O)COCC2=CC=CC=C2)Cl

Isomeric SMILES

CNCCCNC1=C(C=NN(C1=O)COCC2=CC=CC=C2)Cl

InChI

InChI=1S/C16H21ClN4O2/c1-18-8-5-9-19-15-14(17)10-20-21(16(15)22)12-23-11-13-6-3-2-4-7-13/h2-4,6-7,10,18-19H,5,8-9,11-12H2,1H3