2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzothiazole

Systemtic Name: 2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzothiazole Openeye Name: 2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzothiazole CAS Name: 2-[4-(1-pyridin-1-iumylmethyl)phenyl]-1,3-benzothiazole IUPAC Name: 2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzothiazole Traditional Name: 2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzothiazole Formula: C19H15N2S+ MolecularWeight: 303.4008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=[N+](C=C1)CC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H15N2S/c1-4-12-21(13-5-1)14-15-8-10-16(11-9-15)19-20-17-6-2-3-7-18(17)22-19/h1-13H,14H2/q+1