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

Systemtic Name: N-(2,4-dichlorophenyl)-4-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(2,4-dichlorophenyl)-4-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(2,4-dichlorophenyl)-4-(3,4,5-trimethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2,4-dichlorophenyl)-4-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(2,4-dichlorophenyl)-4-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide Formula: C20H23Cl2N3O3S MolecularWeight: 456.38592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2CCN(CC2)C(=S)NC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2CCN(CC2)C(=S)NC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H23Cl2N3O3S/c1-26-17-11-14(12-18(27-2)19(17)28-3)24-6-8-25(9-7-24)20(29)23-16-5-4-13(21)10-15(16)22/h4-5,10-12H,6-9H2,1-3H3,(H,23,29)