(3-propan-2-yl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)methylazanium

Systemtic Name: (3-propan-2-yl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)methylazanium Openeye Name: (3-isopropyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)methylammonium CAS Name: (3-propan-2-yl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)methylammonium IUPAC Name: (3-propan-2-yl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)methylazanium Traditional Name: (3-isopropyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)methylammonium Formula: C13H17N3S+2 MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2[N+](=C(N1)C[NH3+])C3=CC=CC=C3S2

Isomeric SMILES

CC(C)C1=C2[N+](=C(N1)C[NH3+])C3=CC=CC=C3S2

InChI

InChI=1S/C13H15N3S/c1-8(2)12-13-16(11(7-14)15-12)9-5-3-4-6-10(9)17-13/h3-6,8H,7,14H2,1-2H3/p+2