3-[(2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonylamino]propyl-diethyl-azanium

Systemtic Name: 3-[(2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonylamino]propyl-diethyl-azanium Openeye Name: 3-[(2-benzamido-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)amino]propyl-diethyl-ammonium CAS Name: 3-[[(2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[(2-benzamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]propyl-diethylazanium Traditional Name: 3-[(2-benzamido-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)amino]propyl-diethyl-ammonium Formula: C23H32N3O2S+ MolecularWeight: 414.58408

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H31N3O2S/c1-3-26(4-2)16-10-15-24-22(28)20-18-13-8-9-14-19(18)29-23(20)25-21(27)17-11-6-5-7-12-17/h5-7,11-12H,3-4,8-10,13-16H2,1-2H3,(H,24,28)(H,25,27)/p+1