dimethyl-[(1R)-2-[[(2R)-2-phenylpentanoyl]amino]-1-thiophen-2-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1R)-2-[[(2R)-2-phenylpentanoyl]amino]-1-thiophen-2-yl-ethyl]azanium Openeye Name: dimethyl-[(1R)-2-[[(2R)-2-phenylpentanoyl]amino]-1-(2-thienyl)ethyl]ammonium CAS Name: dimethyl-[(1R)-2-[[(2R)-1-oxo-2-phenylpentyl]amino]-1-thiophen-2-ylethyl]ammonium IUPAC Name: dimethyl-[(1R)-2-[[(2R)-2-phenylpentanoyl]amino]-1-thiophen-2-ylethyl]azanium Traditional Name: dimethyl-[(1R)-2-[[(2R)-2-phenylpentanoyl]amino]-1-(2-thienyl)ethyl]ammonium Formula: C19H27N2OS+ MolecularWeight: 331.49548

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)C(=O)NCC(C2=CC=CS2)[NH+](C)C

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)C(=O)NC[C@H](C2=CC=CS2)[NH+](C)C

InChI

InChI=1S/C19H26N2OS/c1-4-9-16(15-10-6-5-7-11-15)19(22)20-14-17(21(2)3)18-12-8-13-23-18/h5-8,10-13,16-17H,4,9,14H2,1-3H3,(H,20,22)/p+1/t16-,17-/m1/s1