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

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]-[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]azanium Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl]-[(R)-(4-ethylphenyl)-(2-thienyl)methyl]ammonium CAS Name: [(2R)-1-amino-1-oxopropan-2-yl]-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]ammonium IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl]-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]azanium Traditional Name: [(1R)-2-amino-2-keto-1-methyl-ethyl]-[(R)-(4-ethylphenyl)-(2-thienyl)methyl]ammonium Formula: C16H21N2OS+ MolecularWeight: 289.41574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2OS/c1-3-12-6-8-13(9-7-12)15(14-5-4-10-20-14)18-11(2)16(17)19/h4-11,15,18H,3H2,1-2H3,(H2,17,19)/p+1/t11-,15-/m1/s1