7-chloranyl-2-[[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 7-chloranyl-2-[[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-chloro-2-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-chloro-2-[[(5-chloro-2-thiophenyl)methyl-ethylamino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-chloro-2-[[(5-chlorothiophen-2-yl)methyl-ethylamino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-chloro-2-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C16H16Cl2N3OS+ MolecularWeight: 369.28874

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)CC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)CC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C16H15Cl2N3OS/c1-2-20(10-13-4-5-14(18)23-13)9-12-7-16(22)21-8-11(17)3-6-15(21)19-12/h3-8H,2,9-10H2,1H3/p+1