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

Systemtic Name: dimethyl-[2-[(4-methylphenyl)carbonyl-(4-methylsulfanyl-1,3-benzothiazol-2-yl)amino]ethyl]azanium Openeye Name: dimethyl-[2-[(4-methylbenzoyl)-(4-methylsulfanyl-1,3-benzothiazol-2-yl)amino]ethyl]ammonium CAS Name: dimethyl-[2-[[(4-methylphenyl)-oxomethyl]-[4-(methylthio)-1,3-benzothiazol-2-yl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[(4-methylbenzoyl)-(4-methylsulfanyl-1,3-benzothiazol-2-yl)amino]ethyl]azanium Traditional Name: dimethyl-[2-[[4-(methylthio)-1,3-benzothiazol-2-yl]-p-toluoyl-amino]ethyl]ammonium Formula: C20H24N3OS2+ MolecularWeight: 386.55406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC[NH+](C)C)C2=NC3=C(S2)C=CC=C3SC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC[NH+](C)C)C2=NC3=C(S2)C=CC=C3SC

InChI

InChI=1S/C20H23N3OS2/c1-14-8-10-15(11-9-14)19(24)23(13-12-22(2)3)20-21-18-16(25-4)6-5-7-17(18)26-20/h5-11H,12-13H2,1-4H3/p+1