N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propionamide Formula: C21H20N4O2S MolecularWeight: 392.4741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2S/c1-2-27-17-9-10-18-19(12-17)28-21(23-18)24-20(26)11-8-15-13-22-25(14-15)16-6-4-3-5-7-16/h3-7,9-10,12-14H,2,8,11H2,1H3,(H,23,24,26)