[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]-[(5-bromanylthiophen-2-yl)methyl]-methyl-azanium

Systemtic Name: [2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]-[(5-bromanylthiophen-2-yl)methyl]-methyl-azanium Openeye Name: (5-bromo-2-thienyl)methyl-[2-(4-carbamoylanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[2-(4-carbamoylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[2-(4-carbamoylanilino)-2-oxoethyl]-methylazanium Traditional Name: (5-bromo-2-thienyl)methyl-[2-(4-carbamoylanilino)-2-keto-ethyl]-methyl-ammonium Formula: C15H17BrN3O2S+ MolecularWeight: 383.28338

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Br)CC(=O)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Br)CC(=O)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C15H16BrN3O2S/c1-19(8-12-6-7-13(16)22-12)9-14(20)18-11-4-2-10(3-5-11)15(17)21/h2-7H,8-9H2,1H3,(H2,17,21)(H,18,20)/p+1