2-(1,3-benzothiazol-2-ylsulfanyl)-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde CAS Name: 2-(1,3-benzothiazol-2-ylthio)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxaldehyde IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Formula: C17H12N3O2S2+ MolecularWeight: 354.42608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=O)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=O)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H11N3O2S2/c1-10-5-4-8-20-14(10)19-15(11(9-21)16(20)22)24-17-18-12-6-2-3-7-13(12)23-17/h2-9H,1H3/p+1