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

Systemtic Name: 5-chloranyl-3-methyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide Formula: C23H22ClN5O2S MolecularWeight: 467.97108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)Cl)CC5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C23H22ClN5O2S/c1-15-20(21(24)29(27-15)14-16-5-3-2-4-6-16)22(30)25-17-7-8-18-19(13-17)32-23(26-18)28-9-11-31-12-10-28/h2-8,13H,9-12,14H2,1H3,(H,25,30)