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

Systemtic Name: N-(3-methoxypropyl)-2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidine-1-carbothioamide Openeye Name: N-(3-methoxypropyl)-2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidine-1-carbothioamide CAS Name: N-(3-methoxypropyl)-2-[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-(3-methoxypropyl)-2-(5-methyl-2-phenyltriazole-4-carbonyl)pyrazolidine-1-carbothioamide Traditional Name: N-(3-methoxypropyl)-2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidine-1-carbothioamide Formula: C18H24N6O2S MolecularWeight: 388.48716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)N2CCCN2C(=S)NCCCOC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)N2CCCN2C(=S)NCCCOC)C3=CC=CC=C3

InChI

InChI=1S/C18H24N6O2S/c1-14-16(21-24(20-14)15-8-4-3-5-9-15)17(25)22-11-7-12-23(22)18(27)19-10-6-13-26-2/h3-5,8-9H,6-7,10-13H2,1-2H3,(H,19,27)