2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonyl-N-(2-morpholin-4-ylethyl)pyrazolidine-1-carbothioamide

Systemtic Name: 2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonyl-N-(2-morpholin-4-ylethyl)pyrazolidine-1-carbothioamide Openeye Name: 2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-N-(2-morpholinoethyl)pyrazolidine-1-carbothioamide CAS Name: 2-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-N-[2-(4-morpholinyl)ethyl]-1-pyrazolidinecarbothioamide IUPAC Name: 2-(5-methyl-1-phenylpyrazole-4-carbonyl)-N-(2-morpholin-4-ylethyl)pyrazolidine-1-carbothioamide Traditional Name: 2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-N-(2-morpholinoethyl)pyrazolidine-1-carbothioamide Formula: C21H28N6O2S MolecularWeight: 428.55102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN3C(=S)NCCN4CCOCC4

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN3C(=S)NCCN4CCOCC4

InChI

InChI=1S/C21H28N6O2S/c1-17-19(16-23-27(17)18-6-3-2-4-7-18)20(28)25-9-5-10-26(25)21(30)22-8-11-24-12-14-29-15-13-24/h2-4,6-7,16H,5,8-15H2,1H3,(H,22,30)