[5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-[(1R)-1-(furan-2-yl)ethyl]azanium

Systemtic Name: [5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-[(1R)-1-(furan-2-yl)ethyl]azanium Openeye Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thienyl]methyl-[(1R)-1-(2-furyl)ethyl]ammonium CAS Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thiophenyl]methyl-[(1R)-1-(2-furanyl)ethyl]ammonium IUPAC Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-[(1R)-1-(furan-2-yl)ethyl]azanium Traditional Name: [5-amino-4-carbethoxy-2-(methylcarbamoyl)-3-thienyl]methyl-[(1R)-1-(2-furyl)ethyl]ammonium Formula: C16H22N3O4S+ MolecularWeight: 352.42858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C[NH2+]C(C)C2=CC=CO2)C(=O)NC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C[NH2+][C@H](C)C2=CC=CO2)C(=O)NC)N

InChI

InChI=1S/C16H21N3O4S/c1-4-22-16(21)12-10(13(15(20)18-3)24-14(12)17)8-19-9(2)11-6-5-7-23-11/h5-7,9,19H,4,8,17H2,1-3H3,(H,18,20)/p+1/t9-/m1/s1