N-(furan-2-ylmethyl)-2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidine-1-carbothioamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidine-1-carbothioamide Openeye Name: N-(2-furylmethyl)-2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-2-[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-2-(5-methyl-2-phenyltriazole-4-carbonyl)pyrazolidine-1-carbothioamide Traditional Name: N-(2-furfuryl)-2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidine-1-carbothioamide Formula: C19H20N6O2S MolecularWeight: 396.4661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)N2CCCN2C(=S)NCC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)N2CCCN2C(=S)NCC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C19H20N6O2S/c1-14-17(22-25(21-14)15-7-3-2-4-8-15)18(26)23-10-6-11-24(23)19(28)20-13-16-9-5-12-27-16/h2-5,7-9,12H,6,10-11,13H2,1H3,(H,20,28)