2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2-iodanylphenyl)prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2-iodanylphenyl)prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2-iodophenyl)prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-(2-iodophenyl)-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2-iodophenyl)prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-(2-iodophenyl)acrylonitrile Formula: C16H9IN2S2 MolecularWeight: 420.29053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2)I

Isomeric SMILES

C1=CC=C(C(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2)I

InChI

InChI=1S/C16H9IN2S2/c17-13-6-2-1-5-11(13)9-12(10-18)20-16-19-14-7-3-4-8-15(14)21-16/h1-9H