[(2S)-1-[(2,4-dimethylphenyl)carbamoylamino]-1-oxidanylidene-propan-2-yl]-methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [(2S)-1-[(2,4-dimethylphenyl)carbamoylamino]-1-oxidanylidene-propan-2-yl]-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [(1S)-2-[(2,4-dimethylphenyl)carbamoylamino]-1-methyl-2-oxo-ethyl]-methyl-(2-thienylmethyl)ammonium CAS Name: [(2S)-1-[[(2,4-dimethylanilino)-oxomethyl]amino]-1-oxopropan-2-yl]-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [(2S)-1-[(2,4-dimethylphenyl)carbamoylamino]-1-oxopropan-2-yl]-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [(1S)-2-[(2,4-dimethylphenyl)carbamoylamino]-2-keto-1-methyl-ethyl]-methyl-(2-thenyl)ammonium Formula: C18H24N3O2S+ MolecularWeight: 346.46706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)[NH+](C)CC2=CC=CS2)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)[C@H](C)[NH+](C)CC2=CC=CS2)C

InChI

InChI=1S/C18H23N3O2S/c1-12-7-8-16(13(2)10-12)19-18(23)20-17(22)14(3)21(4)11-15-6-5-9-24-15/h5-10,14H,11H2,1-4H3,(H2,19,20,22,23)/p+1/t14-/m0/s1