(2-azanyl-2-oxidanylidene-ethyl)-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-propan-2-yl-azanium

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl)-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-propan-2-yl-azanium Openeye Name: (2-amino-2-oxo-ethyl)-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]-isopropyl-ammonium CAS Name: (2-amino-2-oxoethyl)-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-propan-2-ylammonium IUPAC Name: (2-amino-2-oxoethyl)-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]-propan-2-ylazanium Traditional Name: (2-amino-2-keto-ethyl)-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl]-isopropyl-ammonium Formula: C20H32N5O3S+ MolecularWeight: 422.56478

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1C[NH+](CC(=O)N)C(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1C[NH+](CC(=O)N)C(C)C

InChI

InChI=1S/C20H31N5O3S/c1-4-25-18-9-8-16(29(27,28)24-10-6-5-7-11-24)12-17(18)22-20(25)14-23(15(2)3)13-19(21)26/h8-9,12,15H,4-7,10-11,13-14H2,1-3H3,(H2,21,26)/p+1