diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-methylphenyl)carbonyl-amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-methylphenyl)carbonyl-amino]ethyl]azanium Openeye Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-methylbenzoyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-[(2-methylphenyl)-oxomethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-methylbenzoyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-o-toluoyl-amino]ethyl]ammonium Formula: C23H30N3O2S+ MolecularWeight: 412.5682

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)C)OC)C(=O)C3=CC=CC=C3C

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)C)OC)C(=O)C3=CC=CC=C3C

InChI

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