N-(4-butyl-2-methyl-phenyl)-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-butyl-2-methyl-phenyl)-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide Openeye Name: N-(4-butyl-2-methyl-phenyl)-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide CAS Name: N-(4-butyl-2-methylphenyl)-4-(4-methoxyphenyl)-3-methyl-1-piperazinecarbothioamide IUPAC Name: N-(4-butyl-2-methylphenyl)-4-(4-methoxyphenyl)-3-methylpiperazine-1-carbothioamide Traditional Name: N-(4-butyl-2-methyl-phenyl)-4-(4-methoxyphenyl)-3-methyl-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(C(C2)C)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=S)N2CCN(C(C2)C)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C24H33N3OS/c1-5-6-7-20-8-13-23(18(2)16-20)25-24(29)26-14-15-27(19(3)17-26)21-9-11-22(28-4)12-10-21/h8-13,16,19H,5-7,14-15,17H2,1-4H3,(H,25,29)