2-(1,3-benzothiazol-2-ylsulfanyl)-3-[2-[(3-chlorophenyl)methoxy]phenyl]prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[2-[(3-chlorophenyl)methoxy]phenyl]prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[2-[(3-chlorophenyl)methoxy]phenyl]prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-[2-[(3-chlorophenyl)methoxy]phenyl]-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[2-[(3-chlorophenyl)methoxy]phenyl]prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-[2-(3-chlorobenzyl)oxyphenyl]acrylonitrile Formula: C23H15ClN2OS2 MolecularWeight: 434.961

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2)OCC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2)OCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H15ClN2OS2/c24-18-8-5-6-16(12-18)15-27-21-10-3-1-7-17(21)13-19(14-25)28-23-26-20-9-2-4-11-22(20)29-23/h1-13H,15H2