7-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethyl-amino]methyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethyl-amino]methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-methyl-2-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-methyl-2-[[(5-methyl-2-thiophenyl)methyl-phenethylamino]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethylamino]methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-methyl-2-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C24H25N3OS MolecularWeight: 403.5398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CN(CCC3=CC=CC=C3)CC4=CC=C(S4)C)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CN(CCC3=CC=CC=C3)CC4=CC=C(S4)C)C=C1

InChI

InChI=1S/C24H25N3OS/c1-18-8-11-23-25-21(14-24(28)27(23)15-18)16-26(17-22-10-9-19(2)29-22)13-12-20-6-4-3-5-7-20/h3-11,14-15H,12-13,16-17H2,1-2H3