[4-(4-cyanophenyl)phenyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: [4-(4-cyanophenyl)phenyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C23H14N2O2S MolecularWeight: 382.43446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C=CC(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C=C/C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H14N2O2S/c24-15-16-5-7-17(8-6-16)18-9-11-19(12-10-18)27-23(26)14-13-22-25-20-3-1-2-4-21(20)28-22/h1-14H/b14-13+