3-(2,3-didehydro-8aH-quinazolin-3-ium-1-yl)-2H-1,3-benzothiazole

Systemtic Name: 3-(2,3-didehydro-8aH-quinazolin-3-ium-1-yl)-2H-1,3-benzothiazole Openeye Name: 3-(2,3-didehydro-8aH-quinazolin-3-ium-1-yl)-2H-1,3-benzothiazole CAS Name: 3-(2,3-didehydro-8aH-quinazolin-3-ium-1-yl)-2H-1,3-benzothiazole IUPAC Name: 3-(2,3-didehydro-8aH-quinazolin-3-ium-1-yl)-2H-1,3-benzothiazole Traditional Name: 3-(2,3-didehydro-8aH-quinazolin-3-ium-1-yl)-2H-1,3-benzothiazole Formula: C15H12N3S+ MolecularWeight: 266.34088

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C2=CC=CC=C2S1)N3C#[N+]C=C4C3C=CC=C4

Isomeric SMILES

C1N(C2=CC=CC=C2S1)N3C#[N+]C=C4C3C=CC=C4

InChI

InChI=1S/C15H12N3S/c1-2-6-13-12(5-1)9-16-10-17(13)18-11-19-15-8-4-3-7-14(15)18/h1-9,13H,11H2/q+1