N-[4-phenyl-2-phenylazanyl-3-(phenylmethyl)-1,3-thiazol-3-ium-5-yl]furan-2-carboxamide

Systemtic Name: N-[4-phenyl-2-phenylazanyl-3-(phenylmethyl)-1,3-thiazol-3-ium-5-yl]furan-2-carboxamide Openeye Name: N-(2-anilino-3-benzyl-4-phenyl-thiazol-3-ium-5-yl)furan-2-carboxamide CAS Name: N-[2-anilino-4-phenyl-3-(phenylmethyl)-5-thiazol-3-iumyl]-2-furancarboxamide IUPAC Name: N-(2-anilino-3-benzyl-4-phenyl-1,3-thiazol-3-ium-5-yl)furan-2-carboxamide Traditional Name: N-(2-anilino-3-benzyl-4-phenyl-thiazol-3-ium-5-yl)-2-furamide Formula: C27H22N3O2S+ MolecularWeight: 452.54748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(SC(=C2C3=CC=CC=C3)NC(=O)C4=CC=CO4)NC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(SC(=C2C3=CC=CC=C3)NC(=O)C4=CC=CO4)NC5=CC=CC=C5

InChI

InChI=1S/C27H21N3O2S/c31-25(23-17-10-18-32-23)29-26-24(21-13-6-2-7-14-21)30(19-20-11-4-1-5-12-20)27(33-26)28-22-15-8-3-9-16-22/h1-18H,19H2,(H,29,31)/p+1