2-[(E)-2-[1-(phenylmethyl)pyrazol-4-yl]ethenyl]benzo[e][1,3]benzothiazole

Systemtic Name: 2-[(E)-2-[1-(phenylmethyl)pyrazol-4-yl]ethenyl]benzo[e][1,3]benzothiazole Openeye Name: 2-[(E)-2-(1-benzylpyrazol-4-yl)vinyl]benzo[e][1,3]benzothiazole CAS Name: 2-[(E)-2-[1-(phenylmethyl)-4-pyrazolyl]ethenyl]benzo[e][1,3]benzothiazole IUPAC Name: 2-[(E)-2-(1-benzylpyrazol-4-yl)ethenyl]benzo[e][1,3]benzothiazole Traditional Name: 2-[(E)-2-(1-benzylpyrazol-4-yl)vinyl]benzo[e][1,3]benzothiazole Formula: C23H17N3S MolecularWeight: 367.46618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C=CC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)/C=C/C3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

InChI=1S/C23H17N3S/c1-2-6-17(7-3-1)15-26-16-18(14-24-26)10-13-22-25-23-20-9-5-4-8-19(20)11-12-21(23)27-22/h1-14,16H,15H2/b13-10+