N-(5-chloranyl-2-methoxy-phenyl)-2-(furan-2-ylmethylcarbamothioyl)pyrazolidine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-(furan-2-ylmethylcarbamothioyl)pyrazolidine-1-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-(2-furylmethylcarbamothioyl)pyrazolidine-1-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[(2-furanylmethylamino)-sulfanylidenemethyl]-1-pyrazolidinecarboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-(furan-2-ylmethylcarbamothioyl)pyrazolidine-1-carboxamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-(2-furfurylthiocarbamoyl)pyrazolidine-1-carboxamide Formula: C17H19ClN4O3S MolecularWeight: 394.87576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)N2CCCN2C(=S)NCC3=CC=CO3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)N2CCCN2C(=S)NCC3=CC=CO3

InChI

InChI=1S/C17H19ClN4O3S/c1-24-15-6-5-12(18)10-14(15)20-16(23)21-7-3-8-22(21)17(26)19-11-13-4-2-9-25-13/h2,4-6,9-10H,3,7-8,11H2,1H3,(H,19,26)(H,20,23)