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

Systemtic Name: diethyl-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(2-methoxyphenyl)carbonyl-amino]ethyl]azanium Openeye Name: diethyl-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(2-methoxybenzoyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-[(2-methoxyphenyl)-oxomethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(2-methoxybenzoyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-o-anisoyl-amino]ethyl]ammonium Formula: C22H28N3O3S+ MolecularWeight: 414.54102

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=C(S1)C=C(C=C2)OC)C(=O)C3=CC=CC=C3OC

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(S1)C=C(C=C2)OC)C(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C22H27N3O3S/c1-5-24(6-2)13-14-25(21(26)17-9-7-8-10-19(17)28-4)22-23-18-12-11-16(27-3)15-20(18)29-22/h7-12,15H,5-6,13-14H2,1-4H3/p+1