4-(2,4-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: 4-(2,4-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]piperazine-1-carbothioamide Openeye Name: 4-(2,4-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]piperazine-1-carbothioamide CAS Name: 4-(2,4-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: 4-(2,4-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(2,4-dimethoxyphenyl)-N-p-anisyl-piperazine-1-carbothioamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H27N3O3S/c1-25-17-6-4-16(5-7-17)15-22-21(28)24-12-10-23(11-13-24)19-9-8-18(26-2)14-20(19)27-3/h4-9,14H,10-13,15H2,1-3H3,(H,22,28)