dimethyl-[3-[(6-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazol-3-yl)carbonyl-amino]propyl]azanium

Systemtic Name: dimethyl-[3-[(6-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazol-3-yl)carbonyl-amino]propyl]azanium Openeye Name: dimethyl-[3-[(6-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazole-3-carbonyl)amino]propyl]ammonium CAS Name: dimethyl-[3-[(6-methyl-1,3-benzothiazol-2-yl)-[(2-methyl-3-pyrazolyl)-oxomethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(6-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazole-3-carbonyl)amino]propyl]azanium Traditional Name: dimethyl-[3-[(6-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazole-3-carbonyl)amino]propyl]ammonium Formula: C18H24N5OS+ MolecularWeight: 358.48106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CCC[NH+](C)C)C(=O)C3=CC=NN3C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CCC[NH+](C)C)C(=O)C3=CC=NN3C

InChI

InChI=1S/C18H23N5OS/c1-13-6-7-14-16(12-13)25-18(20-14)23(11-5-10-21(2)3)17(24)15-8-9-19-22(15)4/h6-9,12H,5,10-11H2,1-4H3/p+1