2-[[(phenylmethyl)-propyl-amino]methyl]-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-[[(phenylmethyl)-propyl-amino]methyl]-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-[[benzyl(propyl)amino]methyl]-4-(2-thienyl)phthalazin-1-one CAS Name: 2-[[(phenylmethyl)-propylamino]methyl]-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-[[benzyl(propyl)amino]methyl]-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-[[benzyl(propyl)amino]methyl]-4-(2-thienyl)phthalazin-1-one Formula: C23H23N3OS MolecularWeight: 389.51322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

Isomeric SMILES

CCCN(CC1=CC=CC=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

InChI

InChI=1S/C23H23N3OS/c1-2-14-25(16-18-9-4-3-5-10-18)17-26-23(27)20-12-7-6-11-19(20)22(24-26)21-13-8-15-28-21/h3-13,15H,2,14,16-17H2,1H3