[5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]azanium

Systemtic Name: [5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]azanium Openeye Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thienyl]methyl-[(1S)-1-(4-isopropylphenyl)-2-methyl-propyl]ammonium CAS Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thiophenyl]methyl-[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]ammonium IUPAC Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]azanium Traditional Name: [5-amino-4-carbethoxy-2-(methylcarbamoyl)-3-thienyl]methyl-[(1S)-2-methyl-1-p-cumenyl-propyl]ammonium Formula: C23H34N3O3S+ MolecularWeight: 432.59936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N3O3S/c1-7-29-23(28)18-17(20(22(27)25-6)30-21(18)24)12-26-19(14(4)5)16-10-8-15(9-11-16)13(2)3/h8-11,13-14,19,26H,7,12,24H2,1-6H3,(H,25,27)/p+1/t19-/m0/s1