diethyl-[2-[2-[(2-methyl-5-methylsulfonyl-phenyl)carbonylamino]benzimidazol-1-yl]ethyl]azanium

Systemtic Name: diethyl-[2-[2-[(2-methyl-5-methylsulfonyl-phenyl)carbonylamino]benzimidazol-1-yl]ethyl]azanium Openeye Name: diethyl-[2-[2-[(2-methyl-5-methylsulfonyl-benzoyl)amino]benzimidazol-1-yl]ethyl]ammonium CAS Name: diethyl-[2-[2-[[(2-methyl-5-methylsulfonylphenyl)-oxomethyl]amino]-1-benzimidazolyl]ethyl]ammonium IUPAC Name: diethyl-[2-[2-[(2-methyl-5-methylsulfonylbenzoyl)amino]benzimidazol-1-yl]ethyl]azanium Traditional Name: diethyl-[2-[2-[(5-mesyl-2-methyl-benzoyl)amino]benzimidazol-1-yl]ethyl]ammonium Formula: C22H29N4O3S+ MolecularWeight: 429.55566

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C=CC(=C3)S(=O)(=O)C)C

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C=CC(=C3)S(=O)(=O)C)C

InChI

InChI=1S/C22H28N4O3S/c1-5-25(6-2)13-14-26-20-10-8-7-9-19(20)23-22(26)24-21(27)18-15-17(30(4,28)29)12-11-16(18)3/h7-12,15H,5-6,13-14H2,1-4H3,(H,23,24,27)/p+1