(E)-3-(1,3-diphenylpyrazol-4-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-2-(4-phenylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(1,3-diphenyl-4-pyrazolyl)-2-(4-phenyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-2-(4-phenylthiazol-2-yl)acrylonitrile Formula: C27H18N4S MolecularWeight: 430.52362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)C(=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)/C(=C/C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C27H18N4S/c28-17-22(27-29-25(19-32-27)20-10-4-1-5-11-20)16-23-18-31(24-14-8-3-9-15-24)30-26(23)21-12-6-2-7-13-21/h1-16,18-19H/b22-16+