7-methyl-2-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 7-methyl-2-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-methyl-2-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-methyl-2-[[(2-methyl-6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-methyl-2-[(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-methyl-2-[[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C23H19N4OS2+ MolecularWeight: 431.55316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSC3=NC(=NC4=C3C=C(S4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSC3=NC(=NC4=C3C=C(S4)C5=CC=CC=C5)C

InChI

InChI=1S/C23H18N4OS2/c1-14-8-9-20-26-17(10-21(28)27(20)12-14)13-29-22-18-11-19(16-6-4-3-5-7-16)30-23(18)25-15(2)24-22/h3-12H,13H2,1-2H3/p+1