[(1R)-2-[[(2S)-2-(cyclohexylcarbonylamino)-3-methyl-butanoyl]amino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[[(2S)-2-(cyclohexylcarbonylamino)-3-methyl-butanoyl]amino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[[(2S)-2-(cyclohexanecarbonylamino)-3-methyl-butanoyl]amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(2S)-2-[[cyclohexyl(oxo)methyl]amino]-3-methyl-1-oxobutyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[[(2S)-2-(cyclohexanecarbonylamino)-3-methylbutanoyl]amino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[[(2S)-2-(cyclohexanecarbonylamino)-3-methyl-butanoyl]amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C20H34N3O2S+ MolecularWeight: 380.56786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(C1=CSC=C1)[NH+](C)C)NC(=O)C2CCCCC2

Isomeric SMILES

CC(C)[C@@H](C(=O)NC[C@@H](C1=CSC=C1)[NH+](C)C)NC(=O)C2CCCCC2

InChI

InChI=1S/C20H33N3O2S/c1-14(2)18(22-19(24)15-8-6-5-7-9-15)20(25)21-12-17(23(3)4)16-10-11-26-13-16/h10-11,13-15,17-18H,5-9,12H2,1-4H3,(H,21,25)(H,22,24)/p+1/t17-,18-/m0/s1