(5-bromanylthiophen-2-yl)methyl-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-bromo-2-thienyl)methyl]-[2-(3-methylanilino)-2-oxo-ethyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[2-(3-methylanilino)-2-oxoethyl]-prop-2-enylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[2-(3-methylanilino)-2-oxoethyl]-prop-2-enylazanium Traditional Name: allyl-[(5-bromo-2-thienyl)methyl]-[2-keto-2-(m-toluidino)ethyl]ammonium Formula: C17H20BrN2OS+ MolecularWeight: 380.3225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C[NH+](CC=C)CC2=CC=C(S2)Br

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C[NH+](CC=C)CC2=CC=C(S2)Br

InChI

InChI=1S/C17H19BrN2OS/c1-3-9-20(11-15-7-8-16(18)22-15)12-17(21)19-14-6-4-5-13(2)10-14/h3-8,10H,1,9,11-12H2,2H3,(H,19,21)/p+1