2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-diisopropyl-ammonium Formula: C17H28N3S+ MolecularWeight: 306.48932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(C)C1=NC2=CC=CC=C2S1)C(C)C

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)NCC[NH+](C(C)C)C(C)C

InChI

InChI=1S/C17H27N3S/c1-12(2)20(13(3)4)11-10-18-14(5)17-19-15-8-6-7-9-16(15)21-17/h6-9,12-14,18H,10-11H2,1-5H3/p+1/t14-/m1/s1