N-(4-butyl-2-methyl-phenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-butyl-2-methyl-phenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-butyl-2-methyl-phenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butyl-2-methylphenyl)-4-(2-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butyl-2-methylphenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(4-butyl-2-methyl-phenyl)-4-o-phenetyl-piperazine-1-carbothioamide Formula: C24H33N3OS MolecularWeight: 411.60332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC=C3OCC)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC=C3OCC)C

InChI

InChI=1S/C24H33N3OS/c1-4-6-9-20-12-13-21(19(3)18-20)25-24(29)27-16-14-26(15-17-27)22-10-7-8-11-23(22)28-5-2/h7-8,10-13,18H,4-6,9,14-17H2,1-3H3,(H,25,29)