4-ethoxy-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]benzamide

Systemtic Name: 4-ethoxy-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]benzamide Openeye Name: 4-ethoxy-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]benzamide CAS Name: 4-ethoxy-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]benzamide IUPAC Name: 4-ethoxy-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]benzamide Traditional Name: 4-ethoxy-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]benzamide Formula: C22H22N4O3S MolecularWeight: 422.50008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=CC(=NN2C3=NC4=C(C=CC=C4S3)OCC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=CC(=NN2C3=NC4=C(C=CC=C4S3)OCC)C

InChI

InChI=1S/C22H22N4O3S/c1-4-28-16-11-9-15(10-12-16)21(27)23-19-13-14(3)25-26(19)22-24-20-17(29-5-2)7-6-8-18(20)30-22/h6-13H,4-5H2,1-3H3,(H,23,27)