2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C17H13ClN3OS2+ MolecularWeight: 374.88762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CSC3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CSC3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C17H12ClN3OS2/c1-10-3-2-6-21-15(22)8-12(19-16(10)21)9-23-17-20-13-7-11(18)4-5-14(13)24-17/h2-8H,9H2,1H3/p+1