2-[[1-(1-azanyl-1-oxidanylidene-octan-2-yl)-2-(2-methyl-1-oxidanyl-propyl)imidazol-4-yl]carbamoyl]benzenesulfonic acid

Systemtic Name: 2-[[1-(1-azanyl-1-oxidanylidene-octan-2-yl)-2-(2-methyl-1-oxidanyl-propyl)imidazol-4-yl]carbamoyl]benzenesulfonic acid Openeye Name: 2-[[1-(1-carbamoylheptyl)-2-(1-hydroxy-2-methyl-propyl)imidazol-4-yl]carbamoyl]benzenesulfonic acid CAS Name: 2-[[[1-(1-amino-1-oxooctan-2-yl)-2-(1-hydroxy-2-methylpropyl)-4-imidazolyl]amino]-oxomethyl]benzenesulfonic acid IUPAC Name: 2-[[1-(1-amino-1-oxooctan-2-yl)-2-(1-hydroxy-2-methylpropyl)imidazol-4-yl]carbamoyl]benzenesulfonic acid Traditional Name: 2-[[1-(1-carbamoylheptyl)-2-(1-hydroxy-2-methyl-propyl)imidazol-4-yl]carbamoyl]besylic acid Formula: C22H32N4O6S MolecularWeight: 480.57768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)N)N1C=C(N=C1C(C(C)C)O)NC(=O)C2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

CCCCCCC(C(=O)N)N1C=C(N=C1C(C(C)C)O)NC(=O)C2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C22H32N4O6S/c1-4-5-6-7-11-16(20(23)28)26-13-18(24-21(26)19(27)14(2)3)25-22(29)15-10-8-9-12-17(15)33(30,31)32/h8-10,12-14,16,19,27H,4-7,11H2,1-3H3,(H2,23,28)(H,25,29)(H,30,31,32)