[(2R)-1-(1,3-benzothiazol-2-yl)-4-cyclohexyl-butan-2-yl]azanium

Systemtic Name: [(2R)-1-(1,3-benzothiazol-2-yl)-4-cyclohexyl-butan-2-yl]azanium Openeye Name: [(1R)-1-(1,3-benzothiazol-2-ylmethyl)-3-cyclohexyl-propyl]ammonium CAS Name: [(2R)-1-(1,3-benzothiazol-2-yl)-4-cyclohexylbutan-2-yl]ammonium IUPAC Name: [(2R)-1-(1,3-benzothiazol-2-yl)-4-cyclohexylbutan-2-yl]azanium Traditional Name: [(1R)-1-(1,3-benzothiazol-2-ylmethyl)-3-cyclohexyl-propyl]ammonium Formula: C17H25N2S+ MolecularWeight: 289.4588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(CC2=NC3=CC=CC=C3S2)[NH3+]

Isomeric SMILES

C1CCC(CC1)CC[C@H](CC2=NC3=CC=CC=C3S2)[NH3+]

InChI

InChI=1S/C17H24N2S/c18-14(11-10-13-6-2-1-3-7-13)12-17-19-15-8-4-5-9-16(15)20-17/h4-5,8-9,13-14H,1-3,6-7,10-12,18H2/p+1/t14-/m1/s1