4-(5-bromanylthiophen-2-yl)-N-(4-chlorophenyl)-3-(phenylmethyl)-1,3-thiazol-3-ium-2-amine

Systemtic Name: 4-(5-bromanylthiophen-2-yl)-N-(4-chlorophenyl)-3-(phenylmethyl)-1,3-thiazol-3-ium-2-amine Openeye Name: 3-benzyl-4-(5-bromo-2-thienyl)-N-(4-chlorophenyl)thiazol-3-ium-2-amine CAS Name: 4-(5-bromo-2-thiophenyl)-N-(4-chlorophenyl)-3-(phenylmethyl)-2-thiazol-3-iumamine IUPAC Name: 3-benzyl-4-(5-bromothiophen-2-yl)-N-(4-chlorophenyl)-1,3-thiazol-3-ium-2-amine Traditional Name: [3-benzyl-4-(5-bromo-2-thienyl)thiazol-3-ium-2-yl]-(4-chlorophenyl)amine Formula: C20H15BrClN2S2+ MolecularWeight: 462.8335

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(SC=C2C3=CC=C(S3)Br)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(SC=C2C3=CC=C(S3)Br)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H14BrClN2S2/c21-19-11-10-18(26-19)17-13-25-20(23-16-8-6-15(22)7-9-16)24(17)12-14-4-2-1-3-5-14/h1-11,13H,12H2/p+1