[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(1R)-1-pyrimidin-4-ylethyl]azanium

Systemtic Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(1R)-1-pyrimidin-4-ylethyl]azanium Openeye Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(1R)-1-pyrimidin-4-ylethyl]ammonium CAS Name: [3-butyl-2-(cyclobutylmethylsulfonyl)-4-imidazolyl]methyl-methyl-[(1R)-1-(4-pyrimidinyl)ethyl]ammonium IUPAC Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(1R)-1-pyrimidin-4-ylethyl]azanium Traditional Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(1R)-1-(4-pyrimidyl)ethyl]ammonium Formula: C20H32N5O2S+ MolecularWeight: 406.56538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+](C)C(C)C3=NC=NC=C3

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+](C)[C@H](C)C3=NC=NC=C3

InChI

InChI=1S/C20H31N5O2S/c1-4-5-11-25-18(13-24(3)16(2)19-9-10-21-15-23-19)12-22-20(25)28(26,27)14-17-7-6-8-17/h9-10,12,15-17H,4-8,11,13-14H2,1-3H3/p+1/t16-/m1/s1