2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2,3-dimethoxyphenyl)prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2,3-dimethoxyphenyl)prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2,3-dimethoxyphenyl)prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-(2,3-dimethoxyphenyl)-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2,3-dimethoxyphenyl)prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-(2,3-dimethoxyphenyl)acrylonitrile Formula: C18H14N2O2S2 MolecularWeight: 354.44596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=C(C#N)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC=CC(=C1OC)C=C(C#N)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H14N2O2S2/c1-21-15-8-5-6-12(17(15)22-2)10-13(11-19)23-18-20-14-7-3-4-9-16(14)24-18/h3-10H,1-2H3