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

Systemtic Name: N-[4-(4-methylphenyl)-3-[[(2R)-oxolan-2-yl]methyl]-2-phenylazanyl-1,3-thiazol-3-ium-5-yl]ethanamide Openeye Name: N-[2-anilino-4-(p-tolyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiazol-3-ium-5-yl]acetamide CAS Name: N-[2-anilino-4-(4-methylphenyl)-3-[[(2R)-2-oxolanyl]methyl]-5-thiazol-3-iumyl]acetamide IUPAC Name: N-[2-anilino-4-(4-methylphenyl)-3-[[(2R)-oxolan-2-yl]methyl]-1,3-thiazol-3-ium-5-yl]acetamide Traditional Name: N-[2-anilino-4-(p-tolyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiazol-3-ium-5-yl]acetamide Formula: C23H26N3O2S+ MolecularWeight: 408.53644

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O2S/c1-16-10-12-18(13-11-16)21-22(24-17(2)27)29-23(25-19-7-4-3-5-8-19)26(21)15-20-9-6-14-28-20/h3-5,7-8,10-13,20H,6,9,14-15H2,1-2H3,(H,24,27)/p+1/t20-/m1/s1