2-cyano-3-(3-methylthiophen-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)prop-2-enamide

Systemtic Name: 2-cyano-3-(3-methylthiophen-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)prop-2-enamide Openeye Name: 2-cyano-3-(3-methyl-2-thienyl)-N-(2-morpholin-4-ium-4-ylethyl)prop-2-enamide CAS Name: 2-cyano-3-(3-methyl-2-thiophenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-2-propenamide IUPAC Name: 2-cyano-3-(3-methylthiophen-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)prop-2-enamide Traditional Name: 2-cyano-3-(3-methyl-2-thienyl)-N-(2-morpholin-4-ium-4-ylethyl)acrylamide Formula: C15H20N3O2S+ MolecularWeight: 306.4032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=C(C#N)C(=O)NCC[NH+]2CCOCC2

Isomeric SMILES

CC1=C(SC=C1)C=C(C#N)C(=O)NCC[NH+]2CCOCC2

InChI

InChI=1S/C15H19N3O2S/c1-12-2-9-21-14(12)10-13(11-16)15(19)17-3-4-18-5-7-20-8-6-18/h2,9-10H,3-8H2,1H3,(H,17,19)/p+1