N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromanylthiophen-2-yl)methanamine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromanylthiophen-2-yl)methanamine Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromo-2-thienyl)methanamine CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromo-2-thiophenyl)methanamine IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromothiophen-2-yl)methanamine Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(4-bromo-2-thienyl)methyl]amine Formula: C13H11BrN2S2 MolecularWeight: 339.27384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNCC3=CC(=CS3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNCC3=CC(=CS3)Br

InChI

InChI=1S/C13H11BrN2S2/c14-9-5-10(17-8-9)6-15-7-13-16-11-3-1-2-4-12(11)18-13/h1-5,8,15H,6-7H2