N-(2-morpholin-4-ylethyl)-2-(1-phenylcyclopropyl)carbonyl-pyrazolidine-1-carbothioamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-2-(1-phenylcyclopropyl)carbonyl-pyrazolidine-1-carbothioamide Openeye Name: N-(2-morpholinoethyl)-2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbothioamide CAS Name: N-[2-(4-morpholinyl)ethyl]-2-[oxo-(1-phenylcyclopropyl)methyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-(2-morpholin-4-ylethyl)-2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbothioamide Traditional Name: N-(2-morpholinoethyl)-2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbothioamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=S)NCCN2CCOCC2)C(=O)C3(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(N(C1)C(=S)NCCN2CCOCC2)C(=O)C3(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H28N4O2S/c25-18(20(7-8-20)17-5-2-1-3-6-17)23-10-4-11-24(23)19(27)21-9-12-22-13-15-26-16-14-22/h1-3,5-6H,4,7-16H2,(H,21,27)