diethyl-[(3S)-1-[6-(ethylsulfonylamino)-3-methyl-2-phenyl-benzimidazol-4-yl]carbonylpyrrolidin-3-yl]azanium

Systemtic Name: diethyl-[(3S)-1-[6-(ethylsulfonylamino)-3-methyl-2-phenyl-benzimidazol-4-yl]carbonylpyrrolidin-3-yl]azanium Openeye Name: diethyl-[(3S)-1-[6-(ethylsulfonylamino)-3-methyl-2-phenyl-benzimidazole-4-carbonyl]pyrrolidin-3-yl]ammonium CAS Name: diethyl-[(3S)-1-[[6-(ethylsulfonylamino)-3-methyl-2-phenyl-4-benzimidazolyl]-oxomethyl]-3-pyrrolidinyl]ammonium IUPAC Name: diethyl-[(3S)-1-[6-(ethylsulfonylamino)-3-methyl-2-phenylbenzimidazole-4-carbonyl]pyrrolidin-3-yl]azanium Traditional Name: [(3S)-1-[6-(esylamino)-3-methyl-2-phenyl-benzimidazole-4-carbonyl]pyrrolidin-3-yl]-diethyl-ammonium Formula: C25H34N5O3S+ MolecularWeight: 484.63416

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1CCN(C1)C(=O)C2=CC(=CC3=C2N(C(=N3)C4=CC=CC=C4)C)NS(=O)(=O)CC

Isomeric SMILES

CC[NH+](CC)[C@H]1CCN(C1)C(=O)C2=CC(=CC3=C2N(C(=N3)C4=CC=CC=C4)C)NS(=O)(=O)CC

InChI

InChI=1S/C25H33N5O3S/c1-5-29(6-2)20-13-14-30(17-20)25(31)21-15-19(27-34(32,33)7-3)16-22-23(21)28(4)24(26-22)18-11-9-8-10-12-18/h8-12,15-16,20,27H,5-7,13-14,17H2,1-4H3/p+1/t20-/m0/s1