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

Systemtic Name: N-(4-bromophenyl)-4-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-bromophenyl)-4-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(4-bromophenyl)-4-(2,4-dimethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-bromophenyl)-4-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(4-bromophenyl)-4-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide Formula: C19H22BrN3O2S MolecularWeight: 436.36588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C19H22BrN3O2S/c1-24-16-7-8-17(18(13-16)25-2)22-9-11-23(12-10-22)19(26)21-15-5-3-14(20)4-6-15/h3-8,13H,9-12H2,1-2H3,(H,21,26)