2-(3,4-dichlorophenyl)-N-(3-morpholin-4-ylpropyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: 2-(3,4-dichlorophenyl)-N-(3-morpholin-4-ylpropyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: 2-(3,4-dichlorophenyl)-N-(3-morpholinopropyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: 2-(3,4-dichlorophenyl)-N-[3-(4-morpholinyl)propyl]-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: 2-(3,4-dichlorophenyl)-N-(3-morpholin-4-ylpropyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 2-(3,4-dichlorophenyl)-N-(3-morpholinopropyl)-5-(2-thienyl)pyrazole-3-carboxamide Formula: C21H22Cl2N4O2S MolecularWeight: 465.39598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C2=CC(=NN2C3=CC(=C(C=C3)Cl)Cl)C4=CC=CS4

Isomeric SMILES

C1COCCN1CCCNC(=O)C2=CC(=NN2C3=CC(=C(C=C3)Cl)Cl)C4=CC=CS4

InChI

InChI=1S/C21H22Cl2N4O2S/c22-16-5-4-15(13-17(16)23)27-19(14-18(25-27)20-3-1-12-30-20)21(28)24-6-2-7-26-8-10-29-11-9-26/h1,3-5,12-14H,2,6-11H2,(H,24,28)