2-[1-(4-methoxyphenyl)cyclopropyl]carbonyl-N-(pyridin-3-ylmethyl)pyrazolidine-1-carbothioamide

Systemtic Name: 2-[1-(4-methoxyphenyl)cyclopropyl]carbonyl-N-(pyridin-3-ylmethyl)pyrazolidine-1-carbothioamide Openeye Name: 2-[1-(4-methoxyphenyl)cyclopropanecarbonyl]-N-(3-pyridylmethyl)pyrazolidine-1-carbothioamide CAS Name: 2-[[1-(4-methoxyphenyl)cyclopropyl]-oxomethyl]-N-(3-pyridinylmethyl)-1-pyrazolidinecarbothioamide IUPAC Name: 2-[1-(4-methoxyphenyl)cyclopropanecarbonyl]-N-(pyridin-3-ylmethyl)pyrazolidine-1-carbothioamide Traditional Name: 2-[1-(4-methoxyphenyl)cyclopropanecarbonyl]-N-(3-pyridylmethyl)pyrazolidine-1-carbothioamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC2)C(=O)N3CCCN3C(=S)NCC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC2)C(=O)N3CCCN3C(=S)NCC4=CN=CC=C4

InChI

InChI=1S/C21H24N4O2S/c1-27-18-7-5-17(6-8-18)21(9-10-21)19(26)24-12-3-13-25(24)20(28)23-15-16-4-2-11-22-14-16/h2,4-8,11,14H,3,9-10,12-13,15H2,1H3,(H,23,28)