7-methyl-2-[[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-methyl-2-[[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-methyl-2-[[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-methyl-2-[[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-methyl-2-[[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-methyl-2-[[4-(2-thenyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C19H24N4OS+2 MolecularWeight: 356.48506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)C[NH+]3CC[NH+](CC3)CC4=CC=CS4)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)C[NH+]3CC[NH+](CC3)CC4=CC=CS4)C=C1

InChI

InChI=1S/C19H22N4OS/c1-15-4-5-18-20-16(11-19(24)23(18)12-15)13-21-6-8-22(9-7-21)14-17-3-2-10-25-17/h2-5,10-12H,6-9,13-14H2,1H3/p+2