N-[4-(4-methylphenyl)-3-[[(2R)-oxolan-2-yl]methyl]-2-phenylazanyl-1,3-thiazol-3-ium-5-yl]benzamide

Systemtic Name: N-[4-(4-methylphenyl)-3-[[(2R)-oxolan-2-yl]methyl]-2-phenylazanyl-1,3-thiazol-3-ium-5-yl]benzamide Openeye Name: N-[2-anilino-4-(p-tolyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiazol-3-ium-5-yl]benzamide CAS Name: N-[2-anilino-4-(4-methylphenyl)-3-[[(2R)-2-oxolanyl]methyl]-5-thiazol-3-iumyl]benzamide IUPAC Name: N-[2-anilino-4-(4-methylphenyl)-3-[[(2R)-oxolan-2-yl]methyl]-1,3-thiazol-3-ium-5-yl]benzamide Traditional Name: N-[2-anilino-4-(p-tolyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiazol-3-ium-5-yl]benzamide Formula: C28H28N3O2S+ MolecularWeight: 470.60582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=[N+]2CC3CCCO3)NC4=CC=CC=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=[N+]2C[C@H]3CCCO3)NC4=CC=CC=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H27N3O2S/c1-20-14-16-21(17-15-20)25-27(30-26(32)22-9-4-2-5-10-22)34-28(29-23-11-6-3-7-12-23)31(25)19-24-13-8-18-33-24/h2-7,9-12,14-17,24H,8,13,18-19H2,1H3,(H,30,32)/p+1/t24-/m1/s1