4-(2,4-dimethoxyphenyl)-N-(2-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2,4-dimethoxyphenyl)-N-(2-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2,4-dimethoxyphenyl)-N-(2-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(2,4-dimethoxyphenyl)-N-(2-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,4-dimethoxyphenyl)-N-(2-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,4-dimethoxyphenyl)-N-o-phenetyl-piperazine-1-carbothioamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H27N3O3S/c1-4-27-19-8-6-5-7-17(19)22-21(28)24-13-11-23(12-14-24)18-10-9-16(25-2)15-20(18)26-3/h5-10,15H,4,11-14H2,1-3H3,(H,22,28)