1,3-benzothiazol-2-ylmethyl-(4-tert-butylcyclohexyl)azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-(4-tert-butylcyclohexyl)azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-(4-tert-butylcyclohexyl)ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-(4-tert-butylcyclohexyl)ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-(4-tert-butylcyclohexyl)azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-(4-tert-butylcyclohexyl)ammonium Formula: C18H27N2S+ MolecularWeight: 303.48538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)[NH2+]CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)C1CCC(CC1)[NH2+]CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H26N2S/c1-18(2,3)13-8-10-14(11-9-13)19-12-17-20-15-6-4-5-7-16(15)21-17/h4-7,13-14,19H,8-12H2,1-3H3/p+1