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

Systemtic Name: [2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]-(1,3-benzothiazol-2-ylmethyl)-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-(4-carbamoylanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-(4-carbamoylanilino)-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-(4-carbamoylanilino)-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-(4-carbamoylanilino)-2-keto-ethyl]-methyl-ammonium Formula: C18H19N4O2S+ MolecularWeight: 355.43406

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C18H18N4O2S/c1-22(11-17-21-14-4-2-3-5-15(14)25-17)10-16(23)20-13-8-6-12(7-9-13)18(19)24/h2-9H,10-11H2,1H3,(H2,19,24)(H,20,23)/p+1