2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-methoxyphenyl)prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-methoxyphenyl)prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-methoxyphenyl)prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-(4-methoxyphenyl)-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-methoxyphenyl)prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-(4-methoxyphenyl)acrylonitrile Formula: C17H12N2OS2 MolecularWeight: 324.41998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12N2OS2/c1-20-13-8-6-12(7-9-13)10-14(11-18)21-17-19-15-4-2-3-5-16(15)22-17/h2-10H,1H3