(E)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]-N-(1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]-N-(1,3-thiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-N-thiazol-2-yl-prop-2-enamide CAS Name: (E)-3-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]-N-(2-thiazolyl)-2-propenamide IUPAC Name: (E)-3-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)-N-(1,3-thiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-N-thiazol-2-yl-acrylamide Formula: C21H17N5OS MolecularWeight: 387.45758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)C=CC(=O)NC4=NC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)/C=C/C(=O)NC4=NC=CS4

InChI

InChI=1S/C21H17N5OS/c27-19(24-21-23-11-12-28-21)9-8-18-15-26(14-16-5-2-1-3-6-16)25-20(18)17-7-4-10-22-13-17/h1-13,15H,14H2,(H,23,24,27)/b9-8+