4-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazol-3-ium-2-amine

Systemtic Name: 4-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazol-3-ium-2-amine Openeye Name: 4-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-(3-pyridylmethyl)thiazol-3-ium-2-amine CAS Name: 4-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-(3-pyridinylmethyl)-2-thiazol-3-iumamine IUPAC Name: 4-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazol-3-ium-2-amine Traditional Name: [4-(4-chlorophenyl)-3-(3-pyridylmethyl)thiazol-3-ium-2-yl]-(4-methoxyphenyl)amine Formula: C22H19ClN3OS+ MolecularWeight: 408.92376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)Cl)CC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)Cl)CC4=CN=CC=C4

InChI

InChI=1S/C22H18ClN3OS/c1-27-20-10-8-19(9-11-20)25-22-26(14-16-3-2-12-24-13-16)21(15-28-22)17-4-6-18(23)7-5-17/h2-13,15H,14H2,1H3/p+1