methyl-[(2R)-1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl]-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: methyl-[(2R)-1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl]-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: (4-isopropylphenyl)methyl-methyl-[(1R)-1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: methyl-[(2R)-1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl]-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: methyl-[(2R)-1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl]-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: (4-isopropylbenzyl)-[(1R)-2-keto-1-methyl-2-(2-thenylamino)ethyl]-methyl-ammonium Formula: C19H27N2OS+ MolecularWeight: 331.49548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+](C)C(C)C(=O)NCC2=CC=CS2

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CS1)[NH+](C)CC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C19H26N2OS/c1-14(2)17-9-7-16(8-10-17)13-21(4)15(3)19(22)20-12-18-6-5-11-23-18/h5-11,14-15H,12-13H2,1-4H3,(H,20,22)/p+1/t15-/m1/s1