1,3-benzothiazol-2-ylmethyl-[(1R,2R)-2-tert-butylcyclohexyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(1R,2R)-2-tert-butylcyclohexyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(1R,2R)-2-tert-butylcyclohexyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(1R,2R)-2-tert-butylcyclohexyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(1R,2R)-2-tert-butylcyclohexyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1R,2R)-2-tert-butylcyclohexyl]ammonium Formula: C18H27N2S+ MolecularWeight: 303.48538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCCCC1[NH2+]CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H26N2S/c1-18(2,3)13-8-4-5-9-14(13)19-12-17-20-15-10-6-7-11-16(15)21-17/h6-7,10-11,13-14,19H,4-5,8-9,12H2,1-3H3/p+1/t13-,14+/m0/s1