(3-benzamido-2-methoxycarbonyl-thieno[2,3-b]pyridin-6-yl)methyl-(2-ethoxy-2-oxidanylidene-ethyl)-methyl-azanium

Systemtic Name: (3-benzamido-2-methoxycarbonyl-thieno[2,3-b]pyridin-6-yl)methyl-(2-ethoxy-2-oxidanylidene-ethyl)-methyl-azanium Openeye Name: (3-benzamido-2-methoxycarbonyl-thieno[2,3-b]pyridin-6-yl)methyl-(2-ethoxy-2-oxo-ethyl)-methyl-ammonium CAS Name: (3-benzamido-2-methoxycarbonyl-6-thieno[2,3-b]pyridinyl)methyl-(2-ethoxy-2-oxoethyl)-methylammonium IUPAC Name: (3-benzamido-2-methoxycarbonylthieno[2,3-b]pyridin-6-yl)methyl-(2-ethoxy-2-oxoethyl)-methylazanium Traditional Name: (3-benzamido-2-carbomethoxy-thieno[2,3-b]pyridin-6-yl)methyl-(2-ethoxy-2-keto-ethyl)-methyl-ammonium Formula: C22H24N3O5S+ MolecularWeight: 442.50806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[NH+](C)CC1=NC2=C(C=C1)C(=C(S2)C(=O)OC)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C[NH+](C)CC1=NC2=C(C=C1)C(=C(S2)C(=O)OC)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O5S/c1-4-30-17(26)13-25(2)12-15-10-11-16-18(19(22(28)29-3)31-21(16)23-15)24-20(27)14-8-6-5-7-9-14/h5-11H,4,12-13H2,1-3H3,(H,24,27)/p+1