2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-(naphthalen-1-ylmethoxy)phenyl]prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-(naphthalen-1-ylmethoxy)phenyl]prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-(1-naphthylmethoxy)phenyl]prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-[3-(1-naphthalenylmethoxy)phenyl]-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-(naphthalen-1-ylmethoxy)phenyl]prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-[3-(1-naphthylmethoxy)phenyl]acrylonitrile Formula: C27H18N2OS2 MolecularWeight: 450.57462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2COC3=CC=CC(=C3)C=C(C#N)SC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2COC3=CC=CC(=C3)C=C(C#N)SC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H18N2OS2/c28-17-23(31-27-29-25-13-3-4-14-26(25)32-27)16-19-7-5-11-22(15-19)30-18-21-10-6-9-20-8-1-2-12-24(20)21/h1-16H,18H2