2-[4-(1-methylindol-3-yl)-2,6-diphenyl-pyridin-1-ium-1-yl]-1,3-thiazole perchlorate

Systemtic Name: 2-[4-(1-methylindol-3-yl)-2,6-diphenyl-pyridin-1-ium-1-yl]-1,3-thiazole perchlorate Openeye Name: 2-[4-(1-methylindol-3-yl)-2,6-diphenyl-pyridin-1-ium-1-yl]thiazole perchlorate CAS Name: 2-[4-(1-methyl-3-indolyl)-2,6-diphenyl-1-pyridin-1-iumyl]thiazole perchlorate IUPAC Name: 2-[4-(1-methylindol-3-yl)-2,6-diphenylpyridin-1-ium-1-yl]-1,3-thiazole perchlorate Traditional Name: 2-[4-(1-methylindol-3-yl)-2,6-diphenyl-pyridin-1-ium-1-yl]thiazole perchlorate Formula: C29H22ClN3O4S MolecularWeight: 544.02068

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=CC(=[N+](C(=C3)C4=CC=CC=C4)C5=NC=CS5)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=CC(=[N+](C(=C3)C4=CC=CC=C4)C5=NC=CS5)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C29H22N3S.ClHO4/c1-31-20-25(24-14-8-9-15-26(24)31)23-18-27(21-10-4-2-5-11-21)32(29-30-16-17-33-29)28(19-23)22-12-6-3-7-13-22;2-1(3,4)5/h2-20H,1H3;(H,2,3,4,5)/q+1;/p-1