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

Systemtic Name: 4-(4-hydroxyphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-hydroxyphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(4-hydroxyphenyl)-N-(3,4,5-trimethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-hydroxyphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-hydroxyphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S/c1-25-17-12-14(13-18(26-2)19(17)27-3)21-20(28)23-10-8-22(9-11-23)15-4-6-16(24)7-5-15/h4-7,12-13,24H,8-11H2,1-3H3,(H,21,28)