3-(phenylmethyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-2-amine

Systemtic Name: 3-(phenylmethyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-2-amine Openeye Name: 3-benzyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-2-amine CAS Name: 3-(phenylmethyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-2-amine IUPAC Name: 3-benzyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-2-amine Traditional Name: (3-benzyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-2-yl)amine Formula: C14H17N2S+ MolecularWeight: 245.36318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)[N+](=C(S2)N)CC3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(C1)[N+](=C(S2)N)CC3=CC=CC=C3

InChI

InChI=1S/C14H16N2S/c15-14-16(10-11-6-2-1-3-7-11)12-8-4-5-9-13(12)17-14/h1-3,6-7,15H,4-5,8-10H2/p+1