dimethyl-[[4-[[(3-methyl-1-benzothiophen-2-yl)carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[(3-methyl-1-benzothiophen-2-yl)carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[[(3-methylbenzothiophene-2-carbonyl)amino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[[[(3-methyl-1-benzothiophen-2-yl)-oxomethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[[(3-methyl-1-benzothiophene-2-carbonyl)amino]methyl]phenyl]methyl]azanium Traditional Name: dimethyl-[4-[[(3-methylbenzothiophene-2-carbonyl)amino]methyl]benzyl]ammonium Formula: C20H23N2OS+ MolecularWeight: 339.47442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)NCC3=CC=C(C=C3)C[NH+](C)C

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)NCC3=CC=C(C=C3)C[NH+](C)C

InChI

InChI=1S/C20H22N2OS/c1-14-17-6-4-5-7-18(17)24-19(14)20(23)21-12-15-8-10-16(11-9-15)13-22(2)3/h4-11H,12-13H2,1-3H3,(H,21,23)/p+1