N-(1,3-benzothiazol-2-ylmethyl)-1-(4-iodophenyl)ethanamine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-iodophenyl)ethanamine Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-iodophenyl)ethanamine CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-iodophenyl)ethanamine IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-iodophenyl)ethanamine Traditional Name: 1,3-benzothiazol-2-ylmethyl-[1-(4-iodophenyl)ethyl]amine Formula: C16H15IN2S MolecularWeight: 394.27317

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)I)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C1=CC=C(C=C1)I)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H15IN2S/c1-11(12-6-8-13(17)9-7-12)18-10-16-19-14-4-2-3-5-15(14)20-16/h2-9,11,18H,10H2,1H3