1,3-dimethyl-4-pyridin-2-yl-pyrido[2,1-b][1,3]benzothiazol-10-ium perchlorate

Systemtic Name: 1,3-dimethyl-4-pyridin-2-yl-pyrido[2,1-b][1,3]benzothiazol-10-ium perchlorate Openeye Name: 1,3-dimethyl-4-(2-pyridyl)pyrido[2,1-b][1,3]benzothiazol-10-ium perchlorate CAS Name: 1,3-dimethyl-4-(2-pyridinyl)pyrido[2,1-b][1,3]benzothiazol-10-ium perchlorate IUPAC Name: 1,3-dimethyl-4-pyridin-2-ylpyrido[2,1-b][1,3]benzothiazol-10-ium perchlorate Traditional Name: 1,3-dimethyl-4-(2-pyridyl)pyrido[2,1-b][1,3]benzothiazol-10-ium perchlorate Formula: C18H15ClN2O4S MolecularWeight: 390.8407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C3=CC=CC=C3SC2=C1C4=CC=CC=N4)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+]2C3=CC=CC=C3SC2=C1C4=CC=CC=N4)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H15N2S.ClHO4/c1-12-11-13(2)20-15-8-3-4-9-16(15)21-18(20)17(12)14-7-5-6-10-19-14;2-1(3,4)5/h3-11H,1-2H3;(H,2,3,4,5)/q+1;/p-1