2-(6-chloranylpyridin-3-yl)carbonyl-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide

Systemtic Name: 2-(6-chloranylpyridin-3-yl)carbonyl-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide Openeye Name: 2-(6-chloropyridine-3-carbonyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide CAS Name: 2-[(6-chloro-3-pyridinyl)-oxomethyl]-N-[2-(1-cyclohexenyl)ethyl]-1-pyrazolidinecarbothioamide IUPAC Name: 2-(6-chloropyridine-3-carbonyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide Traditional Name: 2-(6-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=CN=C(C=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H23ClN4OS/c19-16-8-7-15(13-21-16)17(24)22-11-4-12-23(22)18(25)20-10-9-14-5-2-1-3-6-14/h5,7-8,13H,1-4,6,9-12H2,(H,20,25)