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

Systemtic Name: 7-methyl-2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-methyl-2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-methyl-2-[[(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-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-methyl-2-[[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C22H17N4OS2+ MolecularWeight: 417.52658

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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

Isomeric SMILES

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

InChI

InChI=1S/C22H16N4OS2/c1-14-7-8-19-25-16(9-20(27)26(19)11-14)12-28-21-17-10-18(15-5-3-2-4-6-15)29-22(17)24-13-23-21/h2-11,13H,12H2,1H3/p+1