2-(2-chloranylpyridin-3-yl)carbonyl-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide

Systemtic Name: 2-(2-chloranylpyridin-3-yl)carbonyl-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide Openeye Name: 2-(2-chloropyridine-3-carbonyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide CAS Name: 2-[(2-chloro-3-pyridinyl)-oxomethyl]-N-[2-(1-cyclohexenyl)ethyl]-1-pyrazolidinecarbothioamide IUPAC Name: 2-(2-chloropyridine-3-carbonyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide Traditional Name: 2-(2-chloronicotinoyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide Formula: C18H23ClN4OS MolecularWeight: 378.91942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=S)N2CCCN2C(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

C1CCC(=CC1)CCNC(=S)N2CCCN2C(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C18H23ClN4OS/c19-16-15(8-4-10-20-16)17(24)22-12-5-13-23(22)18(25)21-11-9-14-6-2-1-3-7-14/h4,6,8,10H,1-3,5,7,9,11-13H2,(H,21,25)