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

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-(cyclohexylcarbamoylamino)-2-oxo-ethyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethyl]-prop-2-enylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[2-(cyclohexylcarbamoylamino)-2-oxoethyl]-prop-2-enylazanium Traditional Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-(cyclohexylcarbamoylamino)-2-keto-ethyl]ammonium Formula: C17H25ClN3O2S+ MolecularWeight: 370.9173

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NC(=O)NC2CCCCC2

Isomeric SMILES

C=CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NC(=O)NC2CCCCC2

InChI

InChI=1S/C17H24ClN3O2S/c1-2-10-21(11-14-8-9-15(18)24-14)12-16(22)20-17(23)19-13-6-4-3-5-7-13/h2,8-9,13H,1,3-7,10-12H2,(H2,19,20,22,23)/p+1