N-[2-[(3-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: N-[2-[(3-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide Openeye Name: N-[2-[(3-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide CAS Name: N-[2-[(3-bromophenyl)methylthio]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: N-[2-[(3-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide Traditional Name: N-[2-[(3-bromobenzyl)thio]-1,3-benzothiazol-6-yl]acetamide Formula: C16H13BrN2OS2 MolecularWeight: 393.32122

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC(=CC=C3)Br

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC(=CC=C3)Br

InChI

InChI=1S/C16H13BrN2OS2/c1-10(20)18-13-5-6-14-15(8-13)22-16(19-14)21-9-11-3-2-4-12(17)7-11/h2-8H,9H2,1H3,(H,18,20)