4-(2-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(2-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H27N3O4S/c1-25-17-8-6-5-7-16(17)23-9-11-24(12-10-23)21(29)22-15-13-18(26-2)20(28-4)19(14-15)27-3/h5-8,13-14H,9-12H2,1-4H3,(H,22,29)