methyl-(phenylmethyl)-[3-[3-(thiophen-3-ylcarbonylamino)propanoylamino]propyl]azanium

Systemtic Name: methyl-(phenylmethyl)-[3-[3-(thiophen-3-ylcarbonylamino)propanoylamino]propyl]azanium Openeye Name: benzyl-methyl-[3-[3-(thiophene-3-carbonylamino)propanoylamino]propyl]ammonium CAS Name: methyl-[3-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propyl]amino]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[3-(thiophene-3-carbonylamino)propanoylamino]propyl]azanium Traditional Name: benzyl-methyl-[3-[3-(3-thenoylamino)propanoylamino]propyl]ammonium Formula: C19H26N3O2S+ MolecularWeight: 360.49364

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)CCNC(=O)C1=CSC=C1)CC2=CC=CC=C2

Isomeric SMILES

C[NH+](CCCNC(=O)CCNC(=O)C1=CSC=C1)CC2=CC=CC=C2

InChI

InChI=1S/C19H25N3O2S/c1-22(14-16-6-3-2-4-7-16)12-5-10-20-18(23)8-11-21-19(24)17-9-13-25-15-17/h2-4,6-7,9,13,15H,5,8,10-12,14H2,1H3,(H,20,23)(H,21,24)/p+1