2-(1,3-benzothiazol-2-ylsulfanyl)-3-[2-[(4-chlorophenyl)methoxy]naphthalen-1-yl]prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[2-[(4-chlorophenyl)methoxy]naphthalen-1-yl]prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[2-[(4-chlorophenyl)methoxy]-1-naphthyl]prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-[2-[(4-chlorophenyl)methoxy]-1-naphthalenyl]-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[2-[(4-chlorophenyl)methoxy]naphthalen-1-yl]prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-[2-(4-chlorobenzyl)oxy-1-naphthyl]acrylonitrile Formula: C27H17ClN2OS2 MolecularWeight: 485.01968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2C=C(C#N)SC3=NC4=CC=CC=C4S3)OCC5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2C=C(C#N)SC3=NC4=CC=CC=C4S3)OCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H17ClN2OS2/c28-20-12-9-18(10-13-20)17-31-25-14-11-19-5-1-2-6-22(19)23(25)15-21(16-29)32-27-30-24-7-3-4-8-26(24)33-27/h1-15H,17H2