N-(4-butan-2-ylphenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2-ethoxyphenyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-(2-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-o-phenetyl-N-(4-sec-butylphenyl)piperazine-1-carbothioamide Formula: C23H31N3OS MolecularWeight: 397.57674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3OS/c1-4-18(3)19-10-12-20(13-11-19)24-23(28)26-16-14-25(15-17-26)21-8-6-7-9-22(21)27-5-2/h6-13,18H,4-5,14-17H2,1-3H3,(H,24,28)