3-methoxy-3-[3-methoxy-5-(naphthalen-2-ylmethoxy)phenyl]-3-(1,3-thiazol-2-yl)propanenitrile

Systemtic Name: 3-methoxy-3-[3-methoxy-5-(naphthalen-2-ylmethoxy)phenyl]-3-(1,3-thiazol-2-yl)propanenitrile Openeye Name: 3-methoxy-3-[3-methoxy-5-(2-naphthylmethoxy)phenyl]-3-thiazol-2-yl-propanenitrile CAS Name: 3-methoxy-3-[3-methoxy-5-(2-naphthalenylmethoxy)phenyl]-3-(2-thiazolyl)propanenitrile IUPAC Name: 3-methoxy-3-[3-methoxy-5-(naphthalen-2-ylmethoxy)phenyl]-3-(1,3-thiazol-2-yl)propanenitrile Traditional Name: 3-methoxy-3-[3-methoxy-5-(2-naphthylmethoxy)phenyl]-3-thiazol-2-yl-propionitrile Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(CC#N)(C2=NC=CS2)OC)OCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=CC(=CC(=C1)C(CC#N)(C2=NC=CS2)OC)OCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H22N2O3S/c1-28-22-14-21(25(29-2,9-10-26)24-27-11-12-31-24)15-23(16-22)30-17-18-7-8-19-5-3-4-6-20(19)13-18/h3-8,11-16H,9,17H2,1-2H3