N-(3-propan-2-yl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzothiazol-2-amine

Systemtic Name: N-(3-propan-2-yl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzothiazol-2-amine Openeye Name: N-(3-isopropyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzothiazol-2-amine CAS Name: N-(3-propan-2-yl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzothiazol-2-amine IUPAC Name: N-(3-propan-2-yl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-(3-isopropyl-1,2,3,4-tetrahydro-s-triazin-3-ium-6-yl)amine Formula: C13H18N5S+ MolecularWeight: 276.38052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CNC(=NC1)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)[NH+]1CNC(=NC1)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H17N5S/c1-9(2)18-7-14-12(15-8-18)17-13-16-10-5-3-4-6-11(10)19-13/h3-6,9H,7-8H2,1-2H3,(H2,14,15,16,17)/p+1