N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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=C5

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CN(N=C4)CC5=CC=CC=C5

InChI

InChI=1S/C22H21N5O2S/c28-21(17-13-23-27(15-17)14-16-4-2-1-3-5-16)24-18-6-7-19-20(12-18)30-22(25-19)26-8-10-29-11-9-26/h1-7,12-13,15H,8-11,14H2,(H,24,28)