methyl-[(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-(thiophen-3-ylmethyl)azanium Openeye Name: methyl-[(1S)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl]-(3-thienylmethyl)ammonium CAS Name: methyl-[(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]-(thiophen-3-ylmethyl)azanium Traditional Name: [(1S)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl]-methyl-(3-thenyl)ammonium Formula: C11H18N3O2S+ MolecularWeight: 256.34452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)[NH+](C)CC1=CSC=C1

InChI

InChI=1S/C11H17N3O2S/c1-8(10(15)13-11(16)12-2)14(3)6-9-4-5-17-7-9/h4-5,7-8H,6H2,1-3H3,(H2,12,13,15,16)/p+1/t8-/m0/s1