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2-[(4-ethyl-1,3-benzothiazol-2-yl)-[3-(4-methylphenyl)sulfanylpropanoyl]amino]ethyl-dimethyl-azanium

2-[(4-ethyl-1,3-benzothiazol-2-yl)-[3-(4-methylphenyl)sulfanylpropanoyl]amino]ethyl-dimethyl-azanium

Systemtic Name:2-[(4-ethyl-1,3-benzothiazol-2-yl)-[3-(4-methylphenyl)sulfanylpropanoyl]amino]ethyl-dimethyl-azanium
Openeye Name:2-[(4-ethyl-1,3-benzothiazol-2-yl)-[3-(p-tolylsulfanyl)propanoyl]amino]ethyl-dimethyl-ammonium
CAS Name:2-[(4-ethyl-1,3-benzothiazol-2-yl)-[3-[(4-methylphenyl)thio]-1-oxopropyl]amino]ethyl-dimethylammonium
IUPAC Name:2-[(4-ethyl-1,3-benzothiazol-2-yl)-[3-(4-methylphenyl)sulfanylpropanoyl]amino]ethyl-dimethylazanium
Traditional Name:2-[(4-ethyl-1,3-benzothiazol-2-yl)-[3-(p-tolylthio)propanoyl]amino]ethyl-dimethyl-ammonium
Formula: C23H30N3OS2+
MolecularWeight: 428.6338
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CC[NH+](C)C)C(=O)CCSC3=CC=C(C=C3)C


Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CC[NH+](C)C)C(=O)CCSC3=CC=C(C=C3)C


InChI

InChI=1S/C23H29N3OS2/c1-5-18-7-6-8-20-22(18)24-23(29-20)26(15-14-25(3)4)21(27)13-16-28-19-11-9-17(2)10-12-19/h6-12H,5,13-16H2,1-4H3/p+1


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