5-bromanyl-N-(phenylmethyl)-1,3-benzothiazol-2-amine

Systemtic Name: 5-bromanyl-N-(phenylmethyl)-1,3-benzothiazol-2-amine Openeye Name: N-benzyl-5-bromo-1,3-benzothiazol-2-amine CAS Name: 5-bromo-N-(phenylmethyl)-1,3-benzothiazol-2-amine IUPAC Name: N-benzyl-5-bromo-1,3-benzothiazol-2-amine Traditional Name: benzyl-(5-bromo-1,3-benzothiazol-2-yl)amine Formula: C14H11BrN2S MolecularWeight: 319.21954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC3=C(S2)C=CC(=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC3=C(S2)C=CC(=C3)Br

InChI

InChI=1S/C14H11BrN2S/c15-11-6-7-13-12(8-11)17-14(18-13)16-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)