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

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidine-1-carbothioamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidine-1-carbothioamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-2-[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-2-(5-methyl-2-phenyltriazole-4-carbonyl)pyrazolidine-1-carbothioamide Traditional Name: 2-(5-methyl-2-phenyl-triazole-4-carbonyl)-N-o-veratryl-pyrazolidine-1-carbothioamide Formula: C23H26N6O3S MolecularWeight: 466.55594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)N2CCCN2C(=S)NCC3=C(C(=CC=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)N2CCCN2C(=S)NCC3=C(C(=CC=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H26N6O3S/c1-16-20(26-29(25-16)18-10-5-4-6-11-18)22(30)27-13-8-14-28(27)23(33)24-15-17-9-7-12-19(31-2)21(17)32-3/h4-7,9-12H,8,13-15H2,1-3H3,(H,24,33)