1-[(2-chlorophenyl)methyl]-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-4-pyrazolecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide Traditional Name: 1-(2-chlorobenzyl)-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide Formula: C22H20ClN5O2S MolecularWeight: 453.9445

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CN(N=C4)CC5=CC=CC=C5Cl

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CN(N=C4)CC5=CC=CC=C5Cl

InChI

InChI=1S/C22H20ClN5O2S/c23-18-4-2-1-3-15(18)13-28-14-16(12-24-28)21(29)25-17-5-6-19-20(11-17)31-22(26-19)27-7-9-30-10-8-27/h1-6,11-12,14H,7-10,13H2,(H,25,29)