dimethyl-[3-[(4-methyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]propyl]azanium

Systemtic Name: dimethyl-[3-[(4-methyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]propyl]azanium Openeye Name: dimethyl-[3-[(4-methyl-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl]ammonium CAS Name: dimethyl-[3-[(4-methyl-1,3-benzothiazol-2-yl)-[oxo(thiophen-2-yl)methyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(4-methyl-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl]azanium Traditional Name: dimethyl-[3-[(4-methyl-1,3-benzothiazol-2-yl)-(2-thenoyl)amino]propyl]ammonium Formula: C18H22N3OS2+ MolecularWeight: 360.51678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC=CS3

InChI

InChI=1S/C18H21N3OS2/c1-13-7-4-8-14-16(13)19-18(24-14)21(11-6-10-20(2)3)17(22)15-9-5-12-23-15/h4-5,7-9,12H,6,10-11H2,1-3H3/p+1