2-[[(5-bromanylthiophen-2-yl)methyl-prop-2-enyl-amino]methyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[(5-bromanylthiophen-2-yl)methyl-prop-2-enyl-amino]methyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[allyl-[(5-bromo-2-thienyl)methyl]amino]methyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(5-bromo-2-thiophenyl)methyl-prop-2-enylamino]methyl]-6-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[(5-bromothiophen-2-yl)methyl-prop-2-enylamino]methyl]-6-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[allyl-[(5-bromo-2-thienyl)methyl]amino]methyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C18H18BrN3OS MolecularWeight: 404.32402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CC(=O)N12)CN(CC=C)CC3=CC=C(S3)Br

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)CN(CC=C)CC3=CC=C(S3)Br

InChI

InChI=1S/C18H18BrN3OS/c1-3-9-21(12-15-7-8-16(19)24-15)11-14-10-18(23)22-13(2)5-4-6-17(22)20-14/h3-8,10H,1,9,11-12H2,2H3