N-[2-[(4-iodophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: N-[2-[(4-iodophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide Openeye Name: N-[2-[(4-iodophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide CAS Name: N-[2-[(4-iodophenyl)methylthio]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: N-[2-[(4-iodophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide Traditional Name: N-[2-[(4-iodobenzyl)thio]-1,3-benzothiazol-6-yl]acetamide Formula: C16H13IN2OS2 MolecularWeight: 440.32169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13IN2OS2/c1-10(20)18-13-6-7-14-15(8-13)22-16(19-14)21-9-11-2-4-12(17)5-3-11/h2-8H,9H2,1H3,(H,18,20)