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

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-methoxy-4-(1-naphthylmethoxy)phenyl]prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-[3-methoxy-4-(1-naphthalenylmethoxy)phenyl]-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-[3-methoxy-4-(1-naphthylmethoxy)phenyl]acrylonitrile Formula: C28H20N2O2S2 MolecularWeight: 480.6006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2)OCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2)OCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H20N2O2S2/c1-31-26-16-19(15-22(17-29)33-28-30-24-11-4-5-12-27(24)34-28)13-14-25(26)32-18-21-9-6-8-20-7-2-3-10-23(20)21/h2-16H,18H2,1H3