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

Systemtic Name: N-(4-butylphenyl)-4-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-butylphenyl)-4-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butylphenyl)-4-(2,4-dimethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butylphenyl)-4-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(4-butylphenyl)-4-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C23H31N3O2S/c1-4-5-6-18-7-9-19(10-8-18)24-23(29)26-15-13-25(14-16-26)21-12-11-20(27-2)17-22(21)28-3/h7-12,17H,4-6,13-16H2,1-3H3,(H,24,29)