[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

Systemtic Name: [(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl]-[(R)-(4-ethylphenyl)-(2-thienyl)methyl]ammonium CAS Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]ammonium IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]azanium Traditional Name: [(1R)-2-anilino-2-keto-1-methyl-ethyl]-[(R)-(4-ethylphenyl)-(2-thienyl)methyl]ammonium Formula: C22H25N2OS+ MolecularWeight: 365.5117

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)[NH2+]C(C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2=CC=CS2)[NH2+][C@H](C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H24N2OS/c1-3-17-11-13-18(14-12-17)21(20-10-7-15-26-20)23-16(2)22(25)24-19-8-5-4-6-9-19/h4-16,21,23H,3H2,1-2H3,(H,24,25)/p+1/t16-,21-/m1/s1