2-[3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide

Systemtic Name: 2-[3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide Openeye Name: 2-[3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)prop-2-enoyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide CAS Name: 2-[3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-1-oxoprop-2-enyl]-N-(3-methoxypropyl)-1-pyrazolidinecarbothioamide IUPAC Name: 2-[3-(5-chloro-1,3-dimethylpyrazol-4-yl)prop-2-enoyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide Traditional Name: 2-[3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)acryloyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide Formula: C16H24ClN5O2S MolecularWeight: 385.91206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)N2CCCN2C(=S)NCCCOC)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)N2CCCN2C(=S)NCCCOC)Cl)C

InChI

InChI=1S/C16H24ClN5O2S/c1-12-13(15(17)20(2)19-12)6-7-14(23)21-9-5-10-22(21)16(25)18-8-4-11-24-3/h6-7H,4-5,8-11H2,1-3H3,(H,18,25)