[(S)-(4-methylphenyl)-phenyl-methyl]-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]azanium

Systemtic Name: [(S)-(4-methylphenyl)-phenyl-methyl]-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]azanium Openeye Name: [(S)-phenyl(p-tolyl)methyl]-[[2-(2-thienyl)oxazol-4-yl]methyl]ammonium CAS Name: [(S)-(4-methylphenyl)-phenylmethyl]-[(2-thiophen-2-yl-4-oxazolyl)methyl]ammonium IUPAC Name: [(S)-(4-methylphenyl)-phenylmethyl]-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]azanium Traditional Name: [(S)-phenyl(p-tolyl)methyl]-[[2-(2-thienyl)oxazol-4-yl]methyl]ammonium Formula: C22H21N2OS+ MolecularWeight: 361.47994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CC3=COC(=N3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)[NH2+]CC3=COC(=N3)C4=CC=CS4

InChI

InChI=1S/C22H20N2OS/c1-16-9-11-18(12-10-16)21(17-6-3-2-4-7-17)23-14-19-15-25-22(24-19)20-8-5-13-26-20/h2-13,15,21,23H,14H2,1H3/p+1/t21-/m0/s1