1,3-benzothiazol-2-ylmethyl-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-(4-ethoxycarbonyl-1-piperazinyl)-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-(4-carbethoxypiperazino)-2-keto-ethyl]-methyl-ammonium Formula: C18H25N4O3S+ MolecularWeight: 377.4811

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C[NH+](C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C[NH+](C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H24N4O3S/c1-3-25-18(24)22-10-8-21(9-11-22)17(23)13-20(2)12-16-19-14-6-4-5-7-15(14)26-16/h4-7H,3,8-13H2,1-2H3/p+1