5,7-dimethyl-3-phenyl-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-carbonitrile perchlorate

Systemtic Name: 5,7-dimethyl-3-phenyl-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-carbonitrile perchlorate Openeye Name: 5,7-dimethyl-3-phenyl-thiazolo[3,2-a]pyridin-4-ium-8-carbonitrile perchlorate CAS Name: 5,7-dimethyl-3-phenyl-8-thiazolo[3,2-a]pyridin-4-iumcarbonitrile perchlorate IUPAC Name: 5,7-dimethyl-3-phenyl-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-carbonitrile perchlorate Traditional Name: 5,7-dimethyl-3-phenyl-thiazolo[3,2-a]pyridin-4-ium-8-carbonitrile perchlorate Formula: C16H13ClN2O4S MolecularWeight: 364.80342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C(=CSC2=C1C#N)C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+]2C(=CSC2=C1C#N)C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C16H13N2S.ClHO4/c1-11-8-12(2)18-15(13-6-4-3-5-7-13)10-19-16(18)14(11)9-17;2-1(3,4)5/h3-8,10H,1-2H3;(H,2,3,4,5)/q+1;/p-1