(5-chloranylthiophen-2-yl)methyl-[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl]-prop-2-enyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-(methylcarbamoylamino)-2-oxo-ethyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[2-(methylcarbamoylamino)-2-oxoethyl]-prop-2-enylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[2-(methylcarbamoylamino)-2-oxoethyl]-prop-2-enylazanium Traditional Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-keto-2-(methylcarbamoylamino)ethyl]ammonium Formula: C12H17ClN3O2S+ MolecularWeight: 302.80028

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C[NH+](CC=C)CC1=CC=C(S1)Cl

Isomeric SMILES

CNC(=O)NC(=O)C[NH+](CC=C)CC1=CC=C(S1)Cl

InChI

InChI=1S/C12H16ClN3O2S/c1-3-6-16(7-9-4-5-10(13)19-9)8-11(17)15-12(18)14-2/h3-5H,1,6-8H2,2H3,(H2,14,15,17,18)/p+1