(3-aminocarbonylphenyl)-[3-aminocarbonyl-5-(phenylmethyl)thiophen-2-yl]-dimethyl-azanium

Systemtic Name: (3-aminocarbonylphenyl)-[3-aminocarbonyl-5-(phenylmethyl)thiophen-2-yl]-dimethyl-azanium Openeye Name: (5-benzyl-3-carbamoyl-2-thienyl)-(3-carbamoylphenyl)-dimethyl-ammonium CAS Name: (3-carbamoylphenyl)-[3-carbamoyl-5-(phenylmethyl)-2-thiophenyl]-dimethylammonium IUPAC Name: (5-benzyl-3-carbamoylthiophen-2-yl)-(3-carbamoylphenyl)-dimethylazanium Traditional Name: (5-benzyl-3-carbamoyl-2-thienyl)-(3-carbamoylphenyl)-dimethyl-ammonium Formula: C21H22N3O2S+ MolecularWeight: 380.48328

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=CC=CC(=C1)C(=O)N)C2=C(C=C(S2)CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C[N+](C)(C1=CC=CC(=C1)C(=O)N)C2=C(C=C(S2)CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C21H21N3O2S/c1-24(2,16-10-6-9-15(12-16)19(22)25)21-18(20(23)26)13-17(27-21)11-14-7-4-3-5-8-14/h3-10,12-13H,11H2,1-2H3,(H3-,22,23,25,26)/p+1