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

Systemtic Name: 6-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethyl-amino]methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 6-methyl-2-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 6-methyl-2-[[(5-methyl-2-thiophenyl)methyl-phenethylamino]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 6-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethylamino]methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 6-methyl-2-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CC(=O)N12)CN(CCC3=CC=CC=C3)CC4=CC=C(S4)C

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)CN(CCC3=CC=CC=C3)CC4=CC=C(S4)C

InChI

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