diethyl-[2-[(6-ethyl-1,3-benzothiazol-2-yl)-(2-methoxyphenyl)carbonyl-amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(6-ethyl-1,3-benzothiazol-2-yl)-(2-methoxyphenyl)carbonyl-amino]ethyl]azanium Openeye Name: diethyl-[2-[(6-ethyl-1,3-benzothiazol-2-yl)-(2-methoxybenzoyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[(6-ethyl-1,3-benzothiazol-2-yl)-[(2-methoxyphenyl)-oxomethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(6-ethyl-1,3-benzothiazol-2-yl)-(2-methoxybenzoyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(6-ethyl-1,3-benzothiazol-2-yl)-o-anisoyl-amino]ethyl]ammonium Formula: C23H30N3O2S+ MolecularWeight: 412.5682

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CC[NH+](CC)CC)C(=O)C3=CC=CC=C3OC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CC[NH+](CC)CC)C(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C23H29N3O2S/c1-5-17-12-13-19-21(16-17)29-23(24-19)26(15-14-25(6-2)7-3)22(27)18-10-8-9-11-20(18)28-4/h8-13,16H,5-7,14-15H2,1-4H3/p+1