4-phenyl-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-phenyl-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-phenyl-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-phenyl-N-(3,4,5-trimethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-phenyl-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-phenyl-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3O3S/c1-24-17-13-15(14-18(25-2)19(17)26-3)21-20(27)23-11-9-22(10-12-23)16-7-5-4-6-8-16/h4-8,13-14H,9-12H2,1-3H3,(H,21,27)