N-(3-methoxypropyl)-2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonyl-pyrazolidine-1-carbothioamide

Systemtic Name: N-(3-methoxypropyl)-2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonyl-pyrazolidine-1-carbothioamide Openeye Name: N-(3-methoxypropyl)-2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)pyrazolidine-1-carbothioamide CAS Name: N-(3-methoxypropyl)-2-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-(3-methoxypropyl)-2-(5-methyl-1-phenylpyrazole-4-carbonyl)pyrazolidine-1-carbothioamide Traditional Name: N-(3-methoxypropyl)-2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)pyrazolidine-1-carbothioamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5O2S/c1-15-17(14-21-24(15)16-8-4-3-5-9-16)18(25)22-11-7-12-23(22)19(27)20-10-6-13-26-2/h3-5,8-9,14H,6-7,10-13H2,1-2H3,(H,20,27)