3-[[5-(furan-2-ylcarbonylamino)thiophen-2-yl]carbonylamino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[5-(furan-2-ylcarbonylamino)thiophen-2-yl]carbonylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[5-(furan-2-carbonylamino)thiophene-2-carbonyl]amino]propyl]-methyl-ammonium CAS Name: 3-[[[5-[[2-furanyl(oxo)methyl]amino]-2-thiophenyl]-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[5-(furan-2-carbonylamino)thiophene-2-carbonyl]amino]propyl]-methylazanium Traditional Name: benzyl-[3-[[5-(2-furoylamino)thiophene-2-carbonyl]amino]propyl]-methyl-ammonium Formula: C21H24N3O3S+ MolecularWeight: 398.49856

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1=CC=C(S1)NC(=O)C2=CC=CO2)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCCNC(=O)C1=CC=C(S1)NC(=O)C2=CC=CO2)CC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3S/c1-24(15-16-7-3-2-4-8-16)13-6-12-22-21(26)18-10-11-19(28-18)23-20(25)17-9-5-14-27-17/h2-5,7-11,14H,6,12-13,15H2,1H3,(H,22,26)(H,23,25)/p+1