dimethyl-[[4-[(6-phenoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[(6-phenoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[(6-phenoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[oxo-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[(6-phenoxy-1,3-benzothiazol-2-yl)carbamoyl]phenyl]methyl]azanium Traditional Name: dimethyl-[4-[(6-phenoxy-1,3-benzothiazol-2-yl)carbamoyl]benzyl]ammonium Formula: C23H22N3O2S+ MolecularWeight: 404.50468

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2S/c1-26(2)15-16-8-10-17(11-9-16)22(27)25-23-24-20-13-12-19(14-21(20)29-23)28-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,24,25,27)/p+1