N-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(3-morpholinopropyl)-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(3-morpholin-4-ylpropyl)-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(3-morpholinopropyl)-3-(2-thienyl)pyrazole-4-carboxamide Formula: C22H26N4O2S MolecularWeight: 410.53244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCCNC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H26N4O2S/c27-22(23-9-5-10-25-11-13-28-14-12-25)19-17-26(16-18-6-2-1-3-7-18)24-21(19)20-8-4-15-29-20/h1-4,6-8,15,17H,5,9-14,16H2,(H,23,27)